id
int64
0
300k
molecules
dict
ground_truth
stringlengths
7
2.47k
messages
listlengths
3
3
297,013
{ "selfies": "[N][#C][C][=N][N][Branch2][Ring1][=N][C][=C][C][Branch1][C][Cl][=C][Branch1][=N][O][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][Branch1][C][Cl][=C][Ring1][S][C][=Branch1][C][=O][C][C][Ring2][Ring1][#Branch1][=O]", "smiles": "N#CC1=NN(c2cc(Cl)c(Oc3ccc(N)cc3)c(Cl)c2)C(=O)CC1=O" }
1-[4-(4-aminophenoxy)-3,5-dichlorophenyl]-4,6-dioxopyridazine-3-carbonitrile
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "1-[4-(4-aminophenoxy)-3,5-dichlorophenyl]-4,6-dioxopyridazine-3-carbonitrile", "role": "assistant" } ]
297,014
{ "selfies": "[C][C][Branch1][C][C][C][=C][C][=C][Branch1][#Branch2][C][N][C][C][C][C][C][Ring1][=Branch1][C][Branch1][C][Cl][=C][Ring1][=C]", "smiles": "CC(C)c1ccc(CN2CCCCC2)c(Cl)c1" }
1-[(2-chloro-4-propan-2-ylphenyl)methyl]piperidine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> The above is a SMILES representation. Write the IUPAC name of the corresponding molecule.", "role": "user" }, { "content": "1-[(2-chloro-4-propan-2-ylphenyl)methyl]piperidine", "role": "assistant" } ]
297,015
{ "selfies": "[O][=C][C][=N][C][=C][N][=C][Ring1][=Branch1][N][=C][Branch1][S][S][C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][N][Ring2][Ring1][Branch1][C][=C][C][=C][C][Branch1][Branch2][C][=N][N][=N][C][Ring1][Branch1][=C][Ring1][O]", "smiles": "O=c1c2nccnc2nc(SCC2=Nc3ccccc3C2)n1-c1cccc(C2=NN=NC2)c1" }
2-(3H-indol-2-ylmethylsulfanyl)-3-[3-(4H-triazol-5-yl)phenyl]pteridin-4-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "2-(3H-indol-2-ylmethylsulfanyl)-3-[3-(4H-triazol-5-yl)phenyl]pteridin-4-one", "role": "assistant" } ]
297,018
{ "selfies": "[C][C][=C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][=Branch2][C][=C][C][=N][N][=C][Ring1][=Branch1][=N][Ring1][O][=C][Ring2][Ring1][O][N][C][C][N][C][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][C][Ring1][S][C][Ring2][Ring1][Ring2]", "smiles": "Cc1c(Oc2ccccc2)ccc(NC(=O)c2csc(-c3ccnnc3)n2)c1N1CCN2CCC(N3C(=O)c4ccccc4C3=O)C2C1" }
N-[2-[(8R,8aR)-8-(1,3-dioxoisoindol-2-yl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-3-methyl-4-phenoxyphenyl]-2-pyridazin-4-yl-1,3-thiazole-4-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "N-[2-[(8R,8aR)-8-(1,3-dioxoisoindol-2-yl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-3-methyl-4-phenoxyphenyl]-2-pyridazin-4-yl-1,3-thiazole-4-carboxamide", "role": "assistant" } ]
297,022
{ "selfies": "[C][O][C][=C][C][Branch2][Ring2][Branch1][N][C][=N][C][Branch2][Ring1][#Branch2][N][C][N][=C][Branch1][#Branch2][N][C][C][C][C][Ring1][Branch1][C][O][C][=C][C][=C][N][Ring1][Branch1][N][=Ring1][S][=C][Ring2][Ring1][=Branch1][=C][C][Branch1][C][C][=C][Ring2][Ring1][=N][C]", "smiles": "COc1cc(-n2cnc(Nc3nc(N4CCCC4CO)c4cccn4n3)c2)cc(C)c1C" }
[(2R)-1-[2-[[1-(3-methoxy-4,5-dimethylphenyl)imidazol-4-yl]amino]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyrrolidin-2-yl]methanol
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "[(2R)-1-[2-[[1-(3-methoxy-4,5-dimethylphenyl)imidazol-4-yl]amino]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyrrolidin-2-yl]methanol", "role": "assistant" } ]
297,026
{ "selfies": "[C][O][C][=C][C][Branch2][Ring1][#C][C][=C][N][=C][C][=C][Branch1][=Branch2][C][C][C][O][C][C][Ring1][=Branch1][C][Branch1][Branch1][O][C][C][O][=C][N][Ring2][Ring1][Ring1][Ring1][S][=C][C][Branch1][#Branch1][O][C][Branch1][C][F][F][=C][Ring2][Ring1][=N][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring1]", "smiles": "COc1cc(-c2cnc3cc(C4CCOCC4)c(OCCO)cn23)cc(OC(F)F)c1C(=O)CC1CC1" }
2-cyclopropyl-1-[2-(difluoromethoxy)-4-[6-(2-hydroxyethoxy)-7-(oxan-4-yl)imidazo[1,2-a]pyridin-3-yl]-6-methoxyphenyl]ethanone
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "2-cyclopropyl-1-[2-(difluoromethoxy)-4-[6-(2-hydroxyethoxy)-7-(oxan-4-yl)imidazo[1,2-a]pyridin-3-yl]-6-methoxyphenyl]ethanone", "role": "assistant" } ]
297,030
{ "selfies": "[C][C][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][Branch2][Ring1][=N][N][C][=N][C][Branch1][P][N][C][C][Branch1][Ring1][C][C][O][C][Branch1][Ring1][C][C][C][Ring1][#Branch2][=N][C][=C][Ring1][S][Cl][=C][C][=C][Ring2][Ring1][Branch2][N][Branch1][=Branch1][C][Branch1][C][C][C][C][Ring2][Ring1][#C][=O]", "smiles": "CCC(=O)COc1cc2cc(Nc3nc(N4CC(CC)OC(CC)C4)ncc3Cl)ccc2n(C(C)C)c1=O" }
6-[[5-chloro-2-[(2S,6R)-2,6-diethylmorpholin-4-yl]pyrimidin-4-yl]amino]-3-(2-oxobutoxy)-1-propan-2-ylquinolin-2-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "6-[[5-chloro-2-[(2S,6R)-2,6-diethylmorpholin-4-yl]pyrimidin-4-yl]amino]-3-(2-oxobutoxy)-1-propan-2-ylquinolin-2-one", "role": "assistant" } ]
297,033
{ "selfies": "[C][C][N][C][C][N][Branch2][Ring2][P][C][=C][C][=C][Branch2][Ring2][Branch1][C][C][=N][C][=C][C][Branch2][Ring1][Branch2][C][=C][C][=C][Branch1][O][N][=C][N][Ring1][Branch1][C][Branch1][C][C][C][C][Branch1][C][F][=N][Ring1][=N][=N][Ring2][Ring1][Ring1][N][=C][Ring2][Ring1][#Branch2][C][C][Ring2][Ring1][S]", "smiles": "CCN1CCN(c2ccc(Cc3nccc(-c4cc5c(ncn5C(C)C)c(F)n4)n3)nc2)CC1" }
6-[2-[[5-(4-ethylpiperazin-1-yl)pyridin-2-yl]methyl]pyrimidin-4-yl]-4-fluoro-1-propan-2-ylimidazo[4,5-c]pyridine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "6-[2-[[5-(4-ethylpiperazin-1-yl)pyridin-2-yl]methyl]pyrimidin-4-yl]-4-fluoro-1-propan-2-ylimidazo[4,5-c]pyridine", "role": "assistant" } ]
297,034
{ "selfies": "[C][C][=C][C][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][O][C][=C][Branch1][C][C][C][Branch1][C][C][=C][C][=C][Ring1][Branch2][Ring1][N]", "smiles": "Cc1ccc2c(n1)oc1c(C)c(C)ccc12" }
7,8-dimethyl-2-(trideuteriomethyl)-[1]benzofuro[2,3-b]pyridine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "7,8-dimethyl-2-(trideuteriomethyl)-[1]benzofuro[2,3-b]pyridine", "role": "assistant" } ]
297,037
{ "selfies": "[C][C][=Branch1][C][=O][C][N][C][C][C][Branch1][C][O][Branch2][Branch1][Ring1][C][N][C][=C][C][=C][Branch2][Ring1][S][N][Branch2][Ring1][#Branch1][C][C][=C][C][=C][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=C][Ring1][N][F][C][C][C][Ring1][Ring1][N][=C][N][=C][Ring2][Ring1][Branch2][Ring2][Ring1][O][C][Branch1][C][O][C][Ring2][Ring2][Ring2]", "smiles": "CC(=O)CN1CCC(O)(Cn2ccc3c(N(Cc4ccc(-c5cnn(C)c5)cc4F)C4CC4)ncnc32)C(O)C1" }
1-[(3R,4R)-4-[[4-[cyclopropyl-[[2-fluoro-4-(1-methylpyrazol-4-yl)phenyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3,4-dihydroxypiperidin-1-yl]propan-2-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Turn the given SMILES symbol of a molecule <molecule_2d> into its respective IUPAC name.", "role": "user" }, { "content": "1-[(3R,4R)-4-[[4-[cyclopropyl-[[2-fluoro-4-(1-methylpyrazol-4-yl)phenyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3,4-dihydroxypiperidin-1-yl]propan-2-one", "role": "assistant" } ]
297,038
{ "selfies": "[C][C][C][O][C][=Branch1][C][=O][C][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][C][C][C][Branch2][Ring1][N][O][C][O][C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][Ring1][C][C][Branch1][=Branch1][N][Branch1][C][C][C][C][Ring1][#C][O][C][Branch1][C][C][Branch1][Ring1][O][C][C][C][Branch1][C][C][C][N][C][Branch1][C][C][C][N][C][=Branch1][C][=O][O][C][Ring2][Ring2][=N][Ring1][=Branch1][C]", "smiles": "CCC1OC(=O)C(C)C(=O)C(C)C(OC2OC(CCCC3CC3)CC(N(C)C)C2O)C(C)(OC)CC(C)CNC(C)C2NC(=O)OC12C" }
(1S,2R,5R,7R,8R,9R,11R,14R,15R)-8-[(2S)-6-(3-cyclopropylpropyl)-4-(dimethylamino)-3-hydroxyoxan-2-yl]oxy-2-ethyl-9-methoxy-1,5,7,9,11,14-hexamethyl-3,18-dioxa-13,16-diazabicyclo[13.3.0]octadecane-4,6,17-trione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "(1S,2R,5R,7R,8R,9R,11R,14R,15R)-8-[(2S)-6-(3-cyclopropylpropyl)-4-(dimethylamino)-3-hydroxyoxan-2-yl]oxy-2-ethyl-9-methoxy-1,5,7,9,11,14-hexamethyl-3,18-dioxa-13,16-diazabicyclo[13.3.0]octadecane-4,6,17-trione", "role": "assistant" } ]
297,039
{ "selfies": "[C][=C][Branch1][C][C][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=C][Branch1][C][O][C][=C][Branch1][P][C][#C][C][#C][C][=N][N][=N][N][=N][N][=N][N][=N][N][=N][C][Branch1][#C][C][=Branch1][C][=O][N][C][C][=C][N][=C][N][=C][Ring1][=Branch1][=C][Ring2][Ring1][P][O]", "smiles": "C=C(C)c1ccc(C)cc1-c1c(O)cc(C#CC#CC=NN=NN=NN=NN=NN=N)c(C(=O)NCc2cncnc2)c1O" }
2,4-dihydroxy-6-[(5Z)-5-[(E)-[(E)-[(E)-[(E)-(iminohydrazinylidene)hydrazinylidene]hydrazinylidene]hydrazinylidene]hydrazinylidene]penta-1,3-diynyl]-3-(5-methyl-2-prop-1-en-2-ylphenyl)-N-(pyrimidin-5-ylmethyl)benzamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "2,4-dihydroxy-6-[(5Z)-5-[(E)-[(E)-[(E)-[(E)-(iminohydrazinylidene)hydrazinylidene]hydrazinylidene]hydrazinylidene]hydrazinylidene]penta-1,3-diynyl]-3-(5-methyl-2-prop-1-en-2-ylphenyl)-N-(pyrimidin-5-ylmethyl)benzamide", "role": "assistant" } ]
297,040
{ "selfies": "[C][N][Branch2][Ring1][=C][C][=C][N][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][C][C][Ring1][Ring2][C][=C][Ring1][#Branch2][=N][Ring1][S][C][=N][C][=N][N][=C][N][Ring1][Branch1][C][=C][C][Branch1][C][Cl][=C][Branch1][C][F][C][=C][Ring1][#C][Ring1][Branch2]", "smiles": "CN(c1cncc(-c2ccc(C3(C)CC3)cc2)n1)c1nc2nncn2c2cc(Cl)c(F)cc12" }
8-chloro-7-fluoro-N-methyl-N-[6-[4-(1-methylcyclopropyl)phenyl]pyrazin-2-yl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "8-chloro-7-fluoro-N-methyl-N-[6-[4-(1-methylcyclopropyl)phenyl]pyrazin-2-yl]-[1,2,4]triazolo[4,3-a]quinazolin-5-amine", "role": "assistant" } ]
297,043
{ "selfies": "[C][C][=C][C][Branch1][C][N][=C][C][=C][Ring1][#Branch1][C][N][=C][Ring1][Branch1][C][C][=C][O][C][=Ring1][Branch1]", "smiles": "Cc1cc(N)cc2c1CN=C2c1ccoc1" }
3-(furan-3-yl)-7-methyl-1H-isoindol-5-amine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "3-(furan-3-yl)-7-methyl-1H-isoindol-5-amine", "role": "assistant" } ]
297,044
{ "selfies": "[C][C][C][C][C][C][Branch1][C][O][C][O][C][C][C][Si][Branch1][C][C][Branch1][#Branch2][O][Si][Branch1][C][C][Branch1][C][C][C][O][Si][Branch1][C][C][Branch1][=Branch1][C][O][C][C][O][O][Si][Branch1][C][C][Branch1][C][C][O][Si][Branch1][C][C][Branch1][C][C][C]", "smiles": "CCCCCC(O)COCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(COCCO)O[Si](C)(C)O[Si](C)(C)C" }
1-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-(2-hydroxyethoxymethyl)-methylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]heptan-2-ol
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "1-[3-[[[dimethyl(trimethylsilyloxy)silyl]oxy-(2-hydroxyethoxymethyl)-methylsilyl]oxy-methyl-trimethylsilyloxysilyl]propoxy]heptan-2-ol", "role": "assistant" } ]
297,045
{ "selfies": "[C][=C][C][C][C][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Ring1][=Branch2][C][Ring1][=N][=O][C][=Branch1][C][=O][N][Ring2][Ring1][Branch1]", "smiles": "C=C1CCC(N2C(=O)c3cnc(C(C)C)cc3C2=O)C(=O)N1" }
2-(6-methylidene-2-oxopiperidin-3-yl)-6-propan-2-ylpyrrolo[3,4-c]pyridine-1,3-dione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "2-(6-methylidene-2-oxopiperidin-3-yl)-6-propan-2-ylpyrrolo[3,4-c]pyridine-1,3-dione", "role": "assistant" } ]
297,046
{ "selfies": "[C][O][C][=C][C][=C][Branch2][Ring2][Ring1][N][C][=N][C][Branch2][Ring1][Branch1][N][C][=C][C][Branch1][C][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][O][=N][C][=C][Ring2][Ring1][C][F][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][N][C]", "smiles": "COc1ccc(Nc2nc(Nc3cc(C)c(OC)c(OC)c3)ncc2F)c(OC)c1C" }
4-N-(2,4-dimethoxy-3-methylphenyl)-2-N-(3,4-dimethoxy-5-methylphenyl)-5-fluoropyrimidine-2,4-diamine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "4-N-(2,4-dimethoxy-3-methylphenyl)-2-N-(3,4-dimethoxy-5-methylphenyl)-5-fluoropyrimidine-2,4-diamine", "role": "assistant" } ]
297,047
{ "selfies": "[C][C][C][Branch1][C][C][C][Branch1][C][C][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][O][Branch1][Ring1][C][F][C][=C][C][=C][C][Branch1][C][N][=N][C][=N][N][Ring1][#Branch2][Ring1][#Branch1]", "smiles": "CCC(C)C(C)C(OCc1ccccc1)C(O)(CF)c1ccc2c(N)ncnn12" }
(3S,5R)-2-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-1-fluoro-4,5-dimethyl-3-phenylmethoxyheptan-2-ol
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "(3S,5R)-2-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-1-fluoro-4,5-dimethyl-3-phenylmethoxyheptan-2-ol", "role": "assistant" } ]
297,050
{ "selfies": "[C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Branch1][C][O][=C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][Ring2][Ring1][C]", "smiles": "CC1=C(C(=O)O)C(O)=C(c2ccc(F)cc2)C(=O)C1" }
5-(4-fluorophenyl)-6-hydroxy-2-methyl-4-oxocyclohexa-1,5-diene-1-carboxylic acid
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "5-(4-fluorophenyl)-6-hydroxy-2-methyl-4-oxocyclohexa-1,5-diene-1-carboxylic acid", "role": "assistant" } ]
297,052
{ "selfies": "[O][=C][Branch2][Ring1][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1]", "smiles": "O=C(CNS(=O)(=O)c1ccccc1)c1cccc(F)c1" }
N-[2-(3-fluorophenyl)-2-oxoethyl]benzenesulfonamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "N-[2-(3-fluorophenyl)-2-oxoethyl]benzenesulfonamide", "role": "assistant" } ]
297,054
{ "selfies": "[C][C][C][Branch1][O][C][Branch1][C][O][C][Branch1][C][O][C][O][O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][Ring1][#C][N][C][=C][Branch2][Ring2][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][N][=N][Ring2][Ring1][=C]", "smiles": "CC1C(C(O)C(O)CO)OC(C(=O)O)=CC1n1cc(-c2ccccc2NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)nn1" }
(2R,3R,4R)-3-methyl-4-[4-[2-[[2-[(4-phenylbenzoyl)amino]acetyl]amino]phenyl]triazol-1-yl]-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "(2R,3R,4R)-3-methyl-4-[4-[2-[[2-[(4-phenylbenzoyl)amino]acetyl]amino]phenyl]triazol-1-yl]-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid", "role": "assistant" } ]
297,057
{ "selfies": "[C][C][C][C][C][C][Branch1][C][C][C][Branch2][=Branch2][=Branch2][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][O][C][C][Branch2][Ring2][#C][C][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][O][C][O][C][O][C][Branch1][C][C][C][C][C][C][Branch1][C][C][C][C][C][Branch1][Branch1][C][Ring1][#C][C][C][Ring1][#C][Ring1][=Branch2][O][O][Ring1][#C][Branch2][Branch1][C][C][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][O][C][O][C][O][C][Branch1][C][C][C][C][C][C][Branch1][C][C][C][C][C][Branch1][C][C][Branch1][Branch1][C][Ring1][S][C][C][Ring1][S][Ring1][#Branch2][O][O][Ring1][S][N][Branch1][C][C][C][O][C][O][C][Branch1][C][C][C][C][C][Ring2][#Branch1][Branch1][C][Ring1][Branch2][Ring2][#Branch1][Ring1][O][O][Ring1][Branch2]", "smiles": "CC1CCC2C(C)C(OC(=O)CCC(=O)OCC(COC(=O)CCC(=O)OC3OC4OC5(C)CCC6C(C)CCC(C3C)C46OO5)(COC(=O)CCC(=O)OC3OC4OC5(C)CCC6C(C)CCC(C)(C3C)C46OO5)N(C)C)OC3OC4(C)CCC1C32OO4" }
1-O-[2-(dimethylamino)-2-[[4-oxo-4-[[(1S,4S,5R,8S,9R,10S,12R,13R)-1,5,8,9-tetramethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl]oxy]butanoyl]oxymethyl]-3-[4-oxo-4-[[(1S,4S,5R,8S,9R,10S,12R,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl]oxy]butanoyl]oxypropyl] 4-O-[(1S,4S,5R,8S,9R,10S,12R,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl] butanedioate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "1-O-[2-(dimethylamino)-2-[[4-oxo-4-[[(1S,4S,5R,8S,9R,10S,12R,13R)-1,5,8,9-tetramethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl]oxy]butanoyl]oxymethyl]-3-[4-oxo-4-[[(1S,4S,5R,8S,9R,10S,12R,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl]oxy]butanoyl]oxypropyl] 4-O-[(1S,4S,5R,8S,9R,10S,12R,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl] butanedioate", "role": "assistant" } ]
297,058
{ "selfies": "[C][C][=C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][F][=C][C][=N][Ring2][Ring1][C]", "smiles": "Cc1cc(NC(=O)Nc2cccc(C)c2F)ccn1" }
1-(2-fluoro-3-methylphenyl)-3-(2-methylpyridin-4-yl)urea
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .", "role": "user" }, { "content": "1-(2-fluoro-3-methylphenyl)-3-(2-methylpyridin-4-yl)urea", "role": "assistant" } ]
297,059
{ "selfies": "[O][=C][C][C][=Branch1][C][=O][C][Branch2][Ring2][P][N][C][=Branch1][C][=O][C][C][C][Branch2][Ring2][C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][NH1][C][=C][Branch1][C][F][C][=C][Branch1][C][F][C][=C][Ring2][Ring1][C][Ring1][Branch2][C][Ring2][Ring1][=Branch1][C][Ring2][Ring1][#C]", "smiles": "O=C1CC(=O)C(NC(=O)C2CC(c3c(-c4ccc(F)cc4)[nH]c4c(F)cc(F)cc34)C2)C1" }
3-[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]-N-[(1S)-2,4-dioxocyclopentyl]cyclobutane-1-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "3-[5,7-difluoro-2-(4-fluorophenyl)-1H-indol-3-yl]-N-[(1S)-2,4-dioxocyclopentyl]cyclobutane-1-carboxamide", "role": "assistant" } ]
297,061
{ "selfies": "[C][C][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][Branch2][Ring2][#C][N][C][=N][C][Branch2][Ring1][P][N][C][C][C][C][Branch2][Ring1][Branch1][C][O][C][=C][C][=C][Branch1][=Branch2][C][C][C][N][C][C][Ring1][=Branch1][C][=C][Ring1][N][C][Ring2][Ring1][Ring2][=N][C][=C][Ring2][Ring1][#Branch2][Cl][=C][C][=C][Ring2][Ring2][C][N][Branch1][C][C][C][Ring2][Ring2][#Branch1][=O]", "smiles": "CCC(=O)COc1cc2cc(Nc3nc(N4CCCC(COc5ccc(C6CCNCC6)cc5)C4)ncc3Cl)ccc2n(C)c1=O" }
6-[[5-chloro-2-[3-[(4-piperidin-4-ylphenoxy)methyl]piperidin-1-yl]pyrimidin-4-yl]amino]-1-methyl-3-(2-oxobutoxy)quinolin-2-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .", "role": "user" }, { "content": "6-[[5-chloro-2-[3-[(4-piperidin-4-ylphenoxy)methyl]piperidin-1-yl]pyrimidin-4-yl]amino]-1-methyl-3-(2-oxobutoxy)quinolin-2-one", "role": "assistant" } ]
297,063
{ "selfies": "[C][=C][O][C][Branch1][C][C][C][Branch1][C][C][C][=N][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Ring1][=N]", "smiles": "C=C1OC(C)C(C)c2nc(Cl)ccc21" }
(7R,8S)-2-chloro-7,8-dimethyl-5-methylidene-7,8-dihydropyrano[4,3-b]pyridine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "(7R,8S)-2-chloro-7,8-dimethyl-5-methylidene-7,8-dihydropyrano[4,3-b]pyridine", "role": "assistant" } ]
297,064
{ "selfies": "[C][C][Branch1][C][C][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][C][=N][C][Branch1][=C][C][=C][C][=C][Branch1][Ring2][C][C][N][C][=C][Ring1][=Branch2][=C][N][=C][Ring1][#C][N]", "smiles": "CC(C)c1nccn1-c1ccncc1CC(=O)c1nc(-c2ccc(CCN)cc2)cnc1N" }
1-[3-amino-6-[4-(2-aminoethyl)phenyl]pyrazin-2-yl]-2-[4-(2-propan-2-ylimidazol-1-yl)pyridin-3-yl]ethanone
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Turn the given SMILES symbol of a molecule <molecule_2d> into its respective IUPAC name.", "role": "user" }, { "content": "1-[3-amino-6-[4-(2-aminoethyl)phenyl]pyrazin-2-yl]-2-[4-(2-propan-2-ylimidazol-1-yl)pyridin-3-yl]ethanone", "role": "assistant" } ]
297,070
{ "selfies": "[C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][Branch2][Ring1][O][C][C][Branch1][C][C][Branch1][C][C][C][#C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][O]", "smiles": "Cc1ccc([N+](=O)[O-])c(CC(C)(C)C#Cc2cccnc2-c2ccccc2)c1" }
3-[3,3-dimethyl-4-(5-methyl-2-nitrophenyl)but-1-ynyl]-2-phenylpyridine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "3-[3,3-dimethyl-4-(5-methyl-2-nitrophenyl)but-1-ynyl]-2-phenylpyridine", "role": "assistant" } ]
297,072
{ "selfies": "[C][C][=Branch1][C][=O][C][C][C][C][Branch1][Ring2][C][Ring1][Ring2][C][C][Branch2][Ring2][=C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][C][=N][N][Branch2][Ring1][Ring2][C][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][C][Ring2][Ring1][#Branch1][=Ring2][Ring1][C][C][Ring2][Ring1][#C]", "smiles": "CC(=O)CC1CC2(C1)CC(CC(=O)c1ccc(C)c3cnn(Cc4ccc(-c5ccccc5)cc4)c13)C2" }
1-[2-[2-[4-methyl-1-[(4-phenylphenyl)methyl]indazol-7-yl]-2-oxoethyl]spiro[3.3]heptan-6-yl]propan-2-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "1-[2-[2-[4-methyl-1-[(4-phenylphenyl)methyl]indazol-7-yl]-2-oxoethyl]spiro[3.3]heptan-6-yl]propan-2-one", "role": "assistant" } ]
297,073
{ "selfies": "[C][C][C][=C][C][=C][Branch2][Ring1][=N][C][N][C][C][N][Branch1][#Branch1][C][C][Branch1][C][C][O][C][C][N][Branch1][#Branch1][C][C][Branch1][C][C][O][C][C][Ring1][P][C][=C][Ring2][Ring1][Branch2]", "smiles": "CCc1ccc(CN2CCN(CC(C)O)CCN(CC(C)O)CC2)cc1" }
(2S)-1-[4-[(4-ethylphenyl)methyl]-7-[(2S)-2-hydroxypropyl]-1,4,7-triazonan-1-yl]propan-2-ol
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "(2S)-1-[4-[(4-ethylphenyl)methyl]-7-[(2S)-2-hydroxypropyl]-1,4,7-triazonan-1-yl]propan-2-ol", "role": "assistant" } ]
297,075
{ "selfies": "[C][O][C][=C][C][=C][C][=Branch1][Branch1][=C][Ring1][=Branch1][Cl][N][Branch1][C][C][C][=Branch1][C][=O][C][C][Branch2][#Branch1][Ring1][O][C][=Branch1][C][=O][C][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Branch1][=Branch1][C][C][=Branch1][C][=O][C][Branch1][#Branch2][C][C][C][N][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C][Branch2][Ring1][#Branch1][C][C][=Branch1][C][=O][C][C][C][C][C][O][C][=Branch1][C][=O][C][Branch1][Ring1][C][Br][C][Br][C][Branch1][C][C][C][C][=C][Ring2][Ring2][Branch2][C][Branch1][C][C][O][C][Ring1][Ring2][C][Branch1][C][C][C][C][C][Branch1][C][O][Branch1][=Branch2][N][C][=Branch1][C][=O][O][Ring1][Branch2][C][Branch1][Ring1][O][C][C][=C][C][=C][Branch1][C][C][C][Ring2][#Branch1][Ring1]", "smiles": "COc1cc2cc(c1Cl)N(C)C(=O)CC(OC(=O)C(C)N(C)C(=O)c1ccc(CC(=O)C(CCCNC(N)=O)NC(=O)C(CC(=O)CCCCCOC(=O)C(CBr)CBr)C(C)C)cc1)C1(C)OC1C(C)C1CC(O)(NC(=O)O1)C(OC)C=CC=C(C)C2" }
[(8S)-8-[[(3S)-6-(carbamoylamino)-1-[4-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21S)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylcarbamoyl]phenyl]-2-oxohexan-3-yl]carbamoyl]-9-methyl-6-oxodecyl] 3-bromo-2-(bromomethyl)propanoate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "[(8S)-8-[[(3S)-6-(carbamoylamino)-1-[4-[[(2S)-1-[[(1S,2R,3S,5S,6S,16E,18E,20R,21S)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl]oxy]-1-oxopropan-2-yl]-methylcarbamoyl]phenyl]-2-oxohexan-3-yl]carbamoyl]-9-methyl-6-oxodecyl] 3-bromo-2-(bromomethyl)propanoate", "role": "assistant" } ]
297,076
{ "selfies": "[C][=C][C][O][C][=C][C][Branch2][Branch1][=N][C][=C][N][=C][Branch2][Branch1][C][C][C][C][C][Ring1][Ring1][C][=N][C][Branch2][Ring1][#Branch2][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][N][C][=C][Branch1][=Branch1][C][Branch1][C][F][F][N][=N][Ring1][Branch2][=C][C][=Branch1][C][=O][N][Ring2][Ring1][=Branch1][Ring2][Ring1][#Branch2][NH1][Ring2][Ring1][#C][=C][C][=C][Ring2][Ring2][Branch1][N][Ring2][Ring2][=Branch2]", "smiles": "C=C1COc2cc(-c3cnc(C4C5CC5c5nc(-c6cc(Cl)ccc6-n6cc(C(F)F)nn6)cc(=O)n54)[nH]3)ccc2N1" }
9-[5-chloro-2-[4-(difluoromethyl)triazol-1-yl]phenyl]-5-[5-(3-methylidene-4H-1,4-benzoxazin-7-yl)-1H-imidazol-2-yl]-6,10-diazatricyclo[4.4.0.02,4]deca-1(10),8-dien-7-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "9-[5-chloro-2-[4-(difluoromethyl)triazol-1-yl]phenyl]-5-[5-(3-methylidene-4H-1,4-benzoxazin-7-yl)-1H-imidazol-2-yl]-6,10-diazatricyclo[4.4.0.02,4]deca-1(10),8-dien-7-one", "role": "assistant" } ]
297,077
{ "selfies": "[C][C][Branch1][C][F][Branch1][C][F][C][Branch1][S][O][C][=Branch1][C][=O][C][C][S][=Branch1][C][=O][=Branch1][C][=O][O][C][Branch1][C][F][Branch1][C][F][F]", "smiles": "CC(F)(F)C(OC(=O)CCS(=O)(=O)O)C(F)(F)F" }
3-oxo-3-(1,1,1,3,3-pentafluorobutan-2-yloxy)propane-1-sulfonic acid
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Please write the IUPAC name of the molecule <molecule_2d> .", "role": "user" }, { "content": "3-oxo-3-(1,1,1,3,3-pentafluorobutan-2-yloxy)propane-1-sulfonic acid", "role": "assistant" } ]
297,081
{ "selfies": "[C][C][C][Branch1][C][O][C][=Branch1][C][=O][O][C][C][=C][Ring1][Branch2][C][=C][N][Branch1][Branch1][C][Ring1][=Branch1][=O][C][C][=C][Ring1][#Branch1][N][=C][C][=C][Branch1][C][F][C][Branch1][C][C][=C][C][Ring1][Branch2][=C][Ring1][N][C][Branch2][=Branch1][#Branch1][C][C][=Branch1][C][=O][C][O][C][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C][C][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][C][Ring1][#Branch1][=O][C][C][Ring2][Branch1][Ring2]", "smiles": "CCC1(O)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1cc(F)c(C)c3c1c2C(CC(=O)COCNC(=O)CCC(=O)C(Cc1ccccc1)NC(=O)CCC(=O)CNC(=O)C(C)CCCCN1C(=O)CC(C)C1=O)CC3" }
N-[5-[[(2S)-6-[[3-[(10S,23S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]-2-oxopropoxy]methylamino]-3,6-dioxo-1-phenylhexan-2-yl]amino]-2,5-dioxopentyl]-2-methyl-6-(3-methyl-2,5-dioxopyrrolidin-1-yl)hexanamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .", "role": "user" }, { "content": "N-[5-[[(2S)-6-[[3-[(10S,23S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]-2-oxopropoxy]methylamino]-3,6-dioxo-1-phenylhexan-2-yl]amino]-2,5-dioxopentyl]-2-methyl-6-(3-methyl-2,5-dioxopyrrolidin-1-yl)hexanamide", "role": "assistant" } ]
297,082
{ "selfies": "[C][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][Branch2][Ring1][=Branch1][C][N][C][C][C][C][C][C][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][Ring1][=Branch2][Ring1][N][C][Branch1][C][C][Branch1][C][C][C]", "smiles": "CCC(C)C(=O)NC(CN1CCC2CCC(NC(C)=O)C21)C(C)(C)C" }
(2R)-N-[(2S)-1-[(3aR,6S,6aS)-6-acetamido-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-yl]-3,3-dimethylbutan-2-yl]-2-methylbutanamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "(2R)-N-[(2S)-1-[(3aR,6S,6aS)-6-acetamido-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-yl]-3,3-dimethylbutan-2-yl]-2-methylbutanamide", "role": "assistant" } ]
297,083
{ "selfies": "[F][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=N][C][=C][C][Branch2][Ring2][Ring2][N][C][=C][C][=N][C][Branch2][Ring1][#Branch1][C][C][=C][C][=C][Branch1][N][N][C][C][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][#C][=N][Ring2][Ring1][=Branch1][=N][Ring2][Ring1][=N]", "smiles": "Fc1ccc(Cl)cc1-c1nccc(Nc2ccnc(Cc3ccc(NCCN4CCOCC4)cc3)n2)n1" }
N-[2-(5-chloro-2-fluorophenyl)pyrimidin-4-yl]-2-[[4-(2-morpholin-4-ylethylamino)phenyl]methyl]pyrimidin-4-amine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Turn the given SMILES symbol of a molecule <molecule_2d> into its respective IUPAC name.", "role": "user" }, { "content": "N-[2-(5-chloro-2-fluorophenyl)pyrimidin-4-yl]-2-[[4-(2-morpholin-4-ylethylamino)phenyl]methyl]pyrimidin-4-amine", "role": "assistant" } ]
297,085
{ "selfies": "[C][C][=N][C][=C][Branch1][P][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][Ring1][#Branch1][C][Ring1][#C]", "smiles": "CC1=NC=C(c2ccc3c(c2)OCCC3)C1" }
4-(3,4-dihydro-2H-chromen-7-yl)-2-methyl-3H-pyrrole
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "4-(3,4-dihydro-2H-chromen-7-yl)-2-methyl-3H-pyrrole", "role": "assistant" } ]
297,087
{ "selfies": "[C][C][Branch1][O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=N][N][C][C][=C][C][Branch2][Ring1][Ring2][C][=C][C][=N][C][Branch1][#Branch2][N][C][=C][C][=N][N][Ring1][Branch1][C][=N][Ring1][=N][=C][N][Ring2][Ring1][C][C][=C][N][Ring2][Ring1][=Branch2][Ring2][Ring1][=Branch1]", "smiles": "CC(Oc1ccccc1F)C1=NNC2c3cc(-c4ccnc(Nc5ccnn5C)n4)cn3C=CN12" }
4-[5-[(1S)-1-(2-fluorophenoxy)ethyl]-3,4,6,9-tetrazatricyclo[7.3.0.02,6]dodeca-1(12),4,7,10-tetraen-11-yl]-N-(2-methylpyrazol-3-yl)pyrimidin-2-amine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .", "role": "user" }, { "content": "4-[5-[(1S)-1-(2-fluorophenoxy)ethyl]-3,4,6,9-tetrazatricyclo[7.3.0.02,6]dodeca-1(12),4,7,10-tetraen-11-yl]-N-(2-methylpyrazol-3-yl)pyrimidin-2-amine", "role": "assistant" } ]
297,088
{ "selfies": "[C][C][=Branch1][C][=O][C][C][N][Branch1][C][C][C][C][=C][C][=C][Branch1][S][N][C][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][C][Ring1][=Branch2][N][=C][Ring1][#C]", "smiles": "CC(=O)CCN(C)Cc1ccc(N2CCN(C(C)=O)CC2)nc1" }
4-[[6-(4-acetylpiperazin-1-yl)pyridin-3-yl]methyl-methylamino]butan-2-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "4-[[6-(4-acetylpiperazin-1-yl)pyridin-3-yl]methyl-methylamino]butan-2-one", "role": "assistant" } ]
297,089
{ "selfies": "[C][C][=C][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=C][Branch1][#C][C][N][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][=N][Ring2][Ring1][Ring1][C][=C][C][=C][Ring2][Ring1][N][C][=C][C][=C][C][Branch2][Ring1][P][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=C][Branch1][O][C][N][C][C][Branch1][C][O][C][Ring1][Branch1][C][=N][Ring1][#C][=C][Ring2][Ring1][Branch2][C]", "smiles": "Cc1c(CC(=O)c2cc(C3CC3)c(CN3CCCCC3C(=O)O)cn2)cccc1-c1cccc(NC(=O)c2cc(C3CC3)c(CN3CC(O)C3)cn2)c1C" }
(2S)-1-[[4-cyclopropyl-6-[2-[3-[3-[[4-cyclopropyl-5-[(3-hydroxyazetidin-1-yl)methyl]pyridine-2-carbonyl]amino]-2-methylphenyl]-2-methylphenyl]acetyl]pyridin-3-yl]methyl]piperidine-2-carboxylic acid
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "(2S)-1-[[4-cyclopropyl-6-[2-[3-[3-[[4-cyclopropyl-5-[(3-hydroxyazetidin-1-yl)methyl]pyridine-2-carbonyl]amino]-2-methylphenyl]-2-methylphenyl]acetyl]pyridin-3-yl]methyl]piperidine-2-carboxylic acid", "role": "assistant" } ]
297,090
{ "selfies": "[C-1][#N+1][C][=C][C][=C][Branch2][Branch1][=C][N][C][C][N][Branch2][Branch1][C][C][C][=C][C][=C][Branch2][Ring2][Branch1][C][C][=C][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][#Branch2][C][C][C][C][=Branch1][C][=C][N][C][Ring1][#Branch1][=O][C][=C][Ring2][Ring1][N][C][C][Ring2][Ring2][Ring1][C][Branch1][C][F][=C][Ring2][Ring2][#Branch2]", "smiles": "[C-]#[N+]c1ccc(N2CCN(Cc3ccc(Cc4ccc5c6c(cccc46)C(=O)N5C4CCC(=C)NC4=O)cc3)CC2)c(F)c1" }
6-[[4-[[4-(2-fluoro-4-isocyanophenyl)piperazin-1-yl]methyl]phenyl]methyl]-1-[(3S)-6-methylidene-2-oxopiperidin-3-yl]benzo[cd]indol-2-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "6-[[4-[[4-(2-fluoro-4-isocyanophenyl)piperazin-1-yl]methyl]phenyl]methyl]-1-[(3S)-6-methylidene-2-oxopiperidin-3-yl]benzo[cd]indol-2-one", "role": "assistant" } ]
297,091
{ "selfies": "[C][C][C][C][N][C][C][Branch1][C][C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Branch1][C][C][N][C][C][=C][N][N][=C][C][=Branch1][#Branch1][=C][Ring1][Branch1][N][=Ring1][=Branch2][C][Ring2][Ring1][=Branch2][=O]", "smiles": "CCCCN1CC(C)Oc2ccc(F)cc2C(C)Nc2ccn3ncc(c3n2)C1=O" }
(3R,11S)-13-butyl-6-fluoro-3,11-dimethyl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaen-14-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "(3R,11S)-13-butyl-6-fluoro-3,11-dimethyl-10-oxa-2,13,17,18,21-pentazatetracyclo[13.5.2.04,9.018,22]docosa-1(21),4(9),5,7,15(22),16,19-heptaen-14-one", "role": "assistant" } ]
297,092
{ "selfies": "[C][#C][N][C][C][C][Branch1][S][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][N][C][Branch1][C][C][C]", "smiles": "C#CN1CCC(C(F)(F)C(F)(F)F)C1C(C)C" }
1-ethynyl-3-(1,1,2,2,2-pentafluoroethyl)-2-propan-2-ylpyrrolidine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "1-ethynyl-3-(1,1,2,2,2-pentafluoroethyl)-2-propan-2-ylpyrrolidine", "role": "assistant" } ]
297,093
{ "selfies": "[C][C][C][Branch1][C][C][=C][C][C][C][Branch1][C][C][=C][C][C][C][Branch1][C][C][=C][C][C][C][Branch1][C][C][=C][C][C][=C][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][=O]", "smiles": "CCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCC1=C(C)C(=O)c2ccccc2C1=O" }
2-methyl-3-[(2E,6E,10E,14E)-3,7,11,15-tetramethylheptadeca-2,6,10,14-tetraenyl]naphthalene-1,4-dione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "2-methyl-3-[(2E,6E,10E,14E)-3,7,11,15-tetramethylheptadeca-2,6,10,14-tetraenyl]naphthalene-1,4-dione", "role": "assistant" } ]
297,095
{ "selfies": "[C][C][C][Branch2][Branch1][=Branch1][O][C][C][Branch1][Ring1][C][O][O][C][Branch2][Ring2][Branch1][O][C][C][Branch1][C][O][C][Branch1][C][N][C][C][Branch1][C][N][C][Ring1][=Branch2][O][C][O][C][Branch1][#Branch1][C][Branch1][C][N][C][F][C][C][C][Ring1][#Branch2][N][C][Ring2][Ring1][=N][O][O][C][Branch1][Ring1][C][N][C][Branch1][C][O][C][Ring2][Ring2][Branch2][O]", "smiles": "CC1C(OC2C(CO)OC(OC3C(O)C(N)CC(N)C3OC3OC(C(N)CF)CCC3N)C2O)OC(CN)C(O)C1O" }
(2S,3S,4R,5R)-2-(aminomethyl)-6-[(2R,3S,4R,5S)-5-[(1R,2R,3S,5R,6S)-3,5-diamino-2-[(2R,3R,6S)-3-amino-6-[(1R)-1-amino-2-fluoroethyl]oxan-2-yl]oxy-6-hydroxycyclohexyl]oxy-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-5-methyloxane-3,4-diol
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "(2S,3S,4R,5R)-2-(aminomethyl)-6-[(2R,3S,4R,5S)-5-[(1R,2R,3S,5R,6S)-3,5-diamino-2-[(2R,3R,6S)-3-amino-6-[(1R)-1-amino-2-fluoroethyl]oxan-2-yl]oxy-6-hydroxycyclohexyl]oxy-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-5-methyloxane-3,4-diol", "role": "assistant" } ]
297,097
{ "selfies": "[C][=C][Branch1][C][C][C][C][C][C][Branch1][C][C][=C][C][Ring1][#Branch1][C][=C][Branch1][C][O][C][=C][Branch1][=Branch1][C][C][C][C][C][C][=C][Ring1][N][O][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][C][N][C]", "smiles": "C=C(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC(=O)NCC(=O)CNC" }
[3-hydroxy-2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylphenyl] N-[3-(methylamino)-2-oxopropyl]carbamate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "[3-hydroxy-2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylphenyl] N-[3-(methylamino)-2-oxopropyl]carbamate", "role": "assistant" } ]
297,100
{ "selfies": "[C][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C][C][C][C][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][Branch2][#Branch2][#Branch2][C][C][C][=Branch1][C][=O][C][C][Branch2][Branch1][P][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][#Branch1][C][C][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch1][C][O][C][Ring1][#Branch2][O][C][C][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch1][C][O][C][Ring1][#Branch2][O][C][=Branch1][C][=O][N][C][C][C][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][#Branch1][C][C][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch1][C][O][C][Ring1][#Branch2][O][C][C][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch1][C][O][C][Ring1][#Branch2][O][C][=Branch1][C][=O][N][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][O][C][O][C][Branch2][Ring1][=Branch1][C][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch1][C][O][C][Ring1][#Branch2][O][C][Branch1][C][O][C][Branch2][Ring1][Branch1][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch1][C][O][C][Ring1][#Branch2][O][C][Ring2][Ring1][S][O]", "smiles": "CC(=O)C(CCCCN)NC(=O)CCCCC(=O)CCC(=O)NC(CCC(=O)CC(CCC(=O)NCCCCCC(=O)N(CCOC1OC(CO)C(O)C(O)C1O)CCOC1OC(CO)C(O)C(O)C1O)C(=O)NCCCCCC(=O)N(CCOC1OC(CO)C(O)C(O)C1O)CCOC1OC(CO)C(O)C(O)C1O)C(=O)NCCCCCC(=O)NCCOC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O" }
(3R,8S)-8-[[9-[[(3S)-7-amino-2-oxoheptan-3-yl]amino]-4,9-dioxononanoyl]amino]-3-N-[6-[bis[2-[(3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]amino]-6-oxohexyl]-8-N-[6-[2-[(2S,3S,4S,5R,6R)-3,5-dihydroxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyethylamino]-6-oxohexyl]-5-oxo-1-N-[6-oxo-6-[2-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl-[2-[(3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]amino]hexyl]octane-1,3,8-tricarboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> The above is a SMILES representation. Write the IUPAC name of the corresponding molecule.", "role": "user" }, { "content": "(3R,8S)-8-[[9-[[(3S)-7-amino-2-oxoheptan-3-yl]amino]-4,9-dioxononanoyl]amino]-3-N-[6-[bis[2-[(3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]amino]-6-oxohexyl]-8-N-[6-[2-[(2S,3S,4S,5R,6R)-3,5-dihydroxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyethylamino]-6-oxohexyl]-5-oxo-1-N-[6-oxo-6-[2-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl-[2-[(3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]amino]hexyl]octane-1,3,8-tricarboxamide", "role": "assistant" } ]
297,103
{ "selfies": "[C][C][=C][C][=C][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#C][=C][C][Branch1][C][C][=C][Ring2][Ring1][Ring2][N][Branch1][C][C][C][Ring2][Ring1][N][=Ring2][Ring1][Branch2]", "smiles": "Cc1cccc2c3c4c5ccccc5n(-c5ccccc5)c4cc(C)c3n(C)c12" }
7,9,11-trimethyl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "7,9,11-trimethyl-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene", "role": "assistant" } ]
297,105
{ "selfies": "[C][O][C][C][C][C][C][C][Branch1][C][C][C][Branch1][C][O][Branch1][Ring2][O][Ring1][Branch2][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][Branch2][Ring2][O][C][Branch1][C][C][C][C][C][C][C][Branch2][Ring1][=Branch1][O][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][Branch1][Ring1][O][C][C][Ring2][Ring1][Branch1][C][C][Branch1][Ring1][O][C][C][Branch1][C][C][C][=C][Branch1][C][C][C][Branch1][C][O][C][Branch1][Ring1][O][C][C][=Branch2][Ring1][=N][=N][O][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][Branch1][C][C][C][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring2][#Branch1][N][C]", "smiles": "COC1CC2CCC(C)C(O)(O2)C(=O)C(=O)N2CCCCC2C(=O)OC(C(C)CC2CCC(OC(=O)Oc3ccc([N+](=O)[O-])cc3)C(OC)C2)CC(OC)C(C)C=C(C)C(O)C(OC)C(=NOCC(=O)OC(=O)Oc2ccc([N+](=O)[O-])cc2)C(C)CC(C)C=CC=CC=C1C" }
(4-nitrophenoxy)carbonyl 2-[[(1R,9S,12S,14R,15R,16E,18R,19S,21R,23S,24E,26E,28E,30S,32S,35R)-1,18-dihydroxy-14,19,30-trimethoxy-12-[(2R)-1-[(1S,3R,4R)-3-methoxy-4-(4-nitrophenoxy)carbonyloxycyclohexyl]propan-2-yl]-15,17,21,23,29,35-hexamethyl-2,3,10-trioxo-11,36-dioxa-4-azatricyclo[30.3.1.04,9]hexatriaconta-16,24,26,28-tetraen-20-ylidene]amino]oxyacetate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "(4-nitrophenoxy)carbonyl 2-[[(1R,9S,12S,14R,15R,16E,18R,19S,21R,23S,24E,26E,28E,30S,32S,35R)-1,18-dihydroxy-14,19,30-trimethoxy-12-[(2R)-1-[(1S,3R,4R)-3-methoxy-4-(4-nitrophenoxy)carbonyloxycyclohexyl]propan-2-yl]-15,17,21,23,29,35-hexamethyl-2,3,10-trioxo-11,36-dioxa-4-azatricyclo[30.3.1.04,9]hexatriaconta-16,24,26,28-tetraen-20-ylidene]amino]oxyacetate", "role": "assistant" } ]
297,106
{ "selfies": "[C][O][C][=C][C][Branch2][Ring2][O][C][=C][N][=C][C][=C][Branch2][Ring1][=Branch2][O][C][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][N][C][=C][N][Ring2][Ring1][#Branch1][Ring2][Ring1][Ring2][=C][C][Branch1][#Branch1][O][C][Branch1][C][F][F][=C][Ring2][Ring1][P][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring1]", "smiles": "COc1cc(-c2cnc3cc(OCC4CCN(C(=O)OC(C)(C)C)C4)ccn23)cc(OC(F)F)c1C(=O)CC1CC1" }
tert-butyl 3-[[3-[4-(2-cyclopropylacetyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxymethyl]pyrrolidine-1-carboxylate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "tert-butyl 3-[[3-[4-(2-cyclopropylacetyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxymethyl]pyrrolidine-1-carboxylate", "role": "assistant" } ]
297,110
{ "selfies": "[C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][=C][C][Branch1][C][O][=C][C][Branch1][C][F][=C][Ring1][Branch2][Ring1][#C]", "smiles": "Cc1ccc2c(c1)C(=O)CCc1cc(O)cc(F)c1-2" }
15-fluoro-13-hydroxy-5-methyltricyclo[9.4.0.02,7]pentadeca-1(11),2(7),3,5,12,14-hexaen-8-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "15-fluoro-13-hydroxy-5-methyltricyclo[9.4.0.02,7]pentadeca-1(11),2(7),3,5,12,14-hexaen-8-one", "role": "assistant" } ]
297,111
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=N][=O][=C][Ring1][#Branch2]", "smiles": "CC(C)(C)OC(=O)Cc1cccc(S(C)(=N)=O)c1" }
tert-butyl 2-[3-(methylsulfonimidoyl)phenyl]acetate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "tert-butyl 2-[3-(methylsulfonimidoyl)phenyl]acetate", "role": "assistant" } ]
297,112
{ "selfies": "[C][O][C][O][C][Branch1][=Branch1][C][Branch1][C][C][=O][C][Branch1][C][C][C][Ring1][=Branch2][O]", "smiles": "COC1OC(C(C)=O)C(C)C1O" }
1-[(3R)-4-hydroxy-5-methoxy-3-methyloxolan-2-yl]ethanone
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "1-[(3R)-4-hydroxy-5-methoxy-3-methyloxolan-2-yl]ethanone", "role": "assistant" } ]
297,113
{ "selfies": "[C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=C][Ring1][=Branch1][N][C][=N][C][=N][C][Branch1][C][N][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=N][C][Ring2][Ring1][Ring2]", "smiles": "COc1cc2c(cc1Nc1ncnc(N)c1C(=O)N(C)C)C=NC2" }
4-amino-6-[(6-methoxy-1H-isoindol-5-yl)amino]-N,N-dimethylpyrimidine-5-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> The above is a SMILES representation. Write the IUPAC name of the corresponding molecule.", "role": "user" }, { "content": "4-amino-6-[(6-methoxy-1H-isoindol-5-yl)amino]-N,N-dimethylpyrimidine-5-carboxamide", "role": "assistant" } ]
297,116
{ "selfies": "[C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=C][C][Branch2][Ring2][#C][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][=C][N][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][=C][C][C][Ring2][Ring1][Branch1][=C][Ring2][Ring1][=C]", "smiles": "CS(=O)(=O)Cc1cccc(C(=O)NC2CCC(Nc3cc(C(F)(F)F)nc(C(F)(F)F)c3)CC2)c1" }
N-[4-[[2,6-bis(trifluoromethyl)pyridin-4-yl]amino]cyclohexyl]-3-(methylsulfonylmethyl)benzamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "N-[4-[[2,6-bis(trifluoromethyl)pyridin-4-yl]amino]cyclohexyl]-3-(methylsulfonylmethyl)benzamide", "role": "assistant" } ]
297,117
{ "selfies": "[C][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][Ring1][C][O][C][C][C][=C][C][=C][Branch1][C][C][C][Branch2][Ring1][=Branch2][C][=C][C][=C][C][=C][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][Ring1][=N][C][=C][Ring2][Ring1][#Branch1]", "smiles": "CC(=O)C(C)(CO)CCc1ccc(C)c(C=Cc2cccc(-c3ccc(Cl)cc3)c2C)c1" }
5-[3-[(E)-2-[3-(4-chlorophenyl)-2-methylphenyl]ethenyl]-4-methylphenyl]-3-(hydroxymethyl)-3-methylpentan-2-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "5-[3-[(E)-2-[3-(4-chlorophenyl)-2-methylphenyl]ethenyl]-4-methylphenyl]-3-(hydroxymethyl)-3-methylpentan-2-one", "role": "assistant" } ]
297,118
{ "selfies": "[C][C][=N][C][Branch1][#Branch2][C][Branch1][C][C][C][C][C][C][N][=C][Branch2][=N][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][=C][Branch1][=Branch1][C][C][C][C][N][S][C][=Ring1][#Branch2][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][=C][Branch1][C][C][S][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C][Branch1][=Branch1][C][C][C][C][N][C][N][=C][Branch1][C][C][S][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][=C][Branch1][=Branch1][C][C][C][C][N][S][C][=Ring1][#Branch2][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][=C][Branch1][C][C][S][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C][Branch1][=Branch1][C][C][C][C][N][C][N][=C][Branch1][C][C][S][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][=C][Branch1][=Branch1][C][C][C][C][N][S][C][=Ring1][#Branch2][C][=Branch1][C][=O][N][C][Branch1][C][C][C][N][=C][Branch1][C][C][S][C][=Ring1][=Branch1][C][Branch1][C][N][=O][S][Ring2][=Branch2][O]", "smiles": "Cc1nc(C(C)CCCCN)c(C(=O)NC(C)c2nc(CCCCN)sc2C(=O)NC(C)c2nc(C)sc2C(=O)NC(CCCCN)c2nc(C)sc2C(=O)NC(C)c2nc(CCCCN)sc2C(=O)NC(C)c2nc(C)sc2C(=O)NC(CCCCN)c2nc(C)sc2C(=O)NC(C)c2nc(CCCCN)sc2C(=O)NC(C)c2nc(C)sc2C(N)=O)s1" }
N-[(1S)-1-[5-[[(1S)-1-[5-[[(1S)-5-amino-1-[5-[[(1S)-1-[5-[[(1S)-1-[5-[[(1S)-5-amino-1-[5-[[(1S)-1-[2-(4-aminobutyl)-5-[[(1S)-1-(5-carbamoyl-2-methyl-1,3-thiazol-4-yl)ethyl]carbamoyl]-1,3-thiazol-4-yl]ethyl]carbamoyl]-2-methyl-1,3-thiazol-4-yl]pentyl]carbamoyl]-2-methyl-1,3-thiazol-4-yl]ethyl]carbamoyl]-2-(4-aminobutyl)-1,3-thiazol-4-yl]ethyl]carbamoyl]-2-methyl-1,3-thiazol-4-yl]pentyl]carbamoyl]-2-methyl-1,3-thiazol-4-yl]ethyl]carbamoyl]-2-(4-aminobutyl)-1,3-thiazol-4-yl]ethyl]-4-[(2S)-6-aminohexan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "N-[(1S)-1-[5-[[(1S)-1-[5-[[(1S)-5-amino-1-[5-[[(1S)-1-[5-[[(1S)-1-[5-[[(1S)-5-amino-1-[5-[[(1S)-1-[2-(4-aminobutyl)-5-[[(1S)-1-(5-carbamoyl-2-methyl-1,3-thiazol-4-yl)ethyl]carbamoyl]-1,3-thiazol-4-yl]ethyl]carbamoyl]-2-methyl-1,3-thiazol-4-yl]pentyl]carbamoyl]-2-methyl-1,3-thiazol-4-yl]ethyl]carbamoyl]-2-(4-aminobutyl)-1,3-thiazol-4-yl]ethyl]carbamoyl]-2-methyl-1,3-thiazol-4-yl]pentyl]carbamoyl]-2-methyl-1,3-thiazol-4-yl]ethyl]carbamoyl]-2-(4-aminobutyl)-1,3-thiazol-4-yl]ethyl]-4-[(2S)-6-aminohexan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide", "role": "assistant" } ]
297,119
{ "selfies": "[C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=C][C][=C][Branch1][S][C][=Branch1][C][=O][C][C][=N][C][Branch1][C][C][=C][S][Ring1][=Branch1][C][=C][Ring1][#C][C][Branch1][C][C][=C][Ring2][Ring1][=Branch1]", "smiles": "CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3nc(C)cs3)cc2)c(C)c1" }
N-methyl-N-[3-methyl-4-[4-[2-(4-methyl-1,3-thiazol-2-yl)acetyl]phenyl]phenyl]propanamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "N-methyl-N-[3-methyl-4-[4-[2-(4-methyl-1,3-thiazol-2-yl)acetyl]phenyl]phenyl]propanamide", "role": "assistant" } ]
297,121
{ "selfies": "[C][C][C][Si][O][Si][Branch1][C][O][Branch1][#Branch2][C][C][C][O][C][C][C][Ring1][Ring1][O][Si][Branch1][C][O][Branch1][#Branch2][C][C][C][O][C][C][O][Ring1][Ring1][O][Si][Branch1][Ring2][C][C][C][Branch1][Branch1][O][Ring2][Ring1][O][O][Si][Branch1][#Branch2][C][C][C][O][C][C][O][Ring1][Ring1][O][Si][Branch1][Ring2][C][C][C][O][Si][Branch1][#Branch2][C][C][C][O][C][C][O][Ring1][Ring1][Branch1][Ring1][O][C][O][Si][Branch1][C][O][Branch1][#Branch2][C][C][C][O][C][C][O][Ring1][Ring1][O][Si][Branch1][Ring2][C][C][C][Branch1][Branch1][O][Ring2][Ring1][#C][O][Si][Branch1][#Branch2][C][C][C][O][C][C][O][Ring1][Ring1][Branch1][Branch1][O][Ring2][=Branch1][=C][O][Ring2][Branch1][Ring1]", "smiles": "CCC[Si]12O[Si](O)(CCCOC3CC3)O[Si](O)(CCCOC3CO3)O[Si](CCC)(O1)O[Si]1(CCCOC3CO3)O[Si]3(CCC)O[Si](CCCOC4CO4)(OC)O[Si](O)(CCCOC4CO4)O[Si](CCC)(O3)O[Si](CCCOC3CO3)(O2)O1" }
5-(3-cyclopropyloxypropyl)-5,7,17-trihydroxy-15-methoxy-1,7,11,15,17-pentakis[3-(oxiran-2-yloxy)propyl]-3,9,13,19-tetrapropyl-2,4,6,8,10,12,14,16,18,20,21,22,23-tridecaoxa-1,3,5,7,9,11,13,15,17,19-decasilatetracyclo[9.9.1.13,9.113,19]tricosane
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "5-(3-cyclopropyloxypropyl)-5,7,17-trihydroxy-15-methoxy-1,7,11,15,17-pentakis[3-(oxiran-2-yloxy)propyl]-3,9,13,19-tetrapropyl-2,4,6,8,10,12,14,16,18,20,21,22,23-tridecaoxa-1,3,5,7,9,11,13,15,17,19-decasilatetracyclo[9.9.1.13,9.113,19]tricosane", "role": "assistant" } ]
297,122
{ "selfies": "[C][C][=C][Branch2][Ring2][N][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=Branch1][Ring2][=N][Ring1][Branch1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][Branch1][Ring1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][Ring2][Ring1][C][C][=N][N][Ring2][Ring1][N][C][C][Branch1][C][C][F]", "smiles": "Cc1c(S(=O)(=O)n2cc3c(n2)CN(C(=O)C(CO)c2ccccc2F)C3)cnn1CC(C)F" }
(2S)-2-(2-fluorophenyl)-1-[2-[1-(2-fluoropropyl)-5-methylpyrazol-4-yl]sulfonyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl]-3-hydroxypropan-1-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "(2S)-2-(2-fluorophenyl)-1-[2-[1-(2-fluoropropyl)-5-methylpyrazol-4-yl]sulfonyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl]-3-hydroxypropan-1-one", "role": "assistant" } ]
297,125
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][=N][C][Ring1][Branch1]", "smiles": "CC(C)(C)NCC(O)c1cc(F)cc2c1C=NC2" }
(1R)-2-(tert-butylamino)-1-(6-fluoro-1H-isoindol-4-yl)ethanol
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "(1R)-2-(tert-butylamino)-1-(6-fluoro-1H-isoindol-4-yl)ethanol", "role": "assistant" } ]
297,126
{ "selfies": "[C][C][N][=C][S][C][=Ring1][Branch1][C][=C][C][=C][Branch2][Ring2][Branch2][C][C][C][=Branch1][C][=O][C][C][C][Branch1][C][O][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][Ring1][C][S][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][=O][C][=C][Ring2][Ring1][#C]", "smiles": "Cc1ncsc1-c1ccc(CCC(=O)C2CC(O)CN2C(=O)C(CS)C2Cc3ccccc3C2=O)cc1" }
2-[(2R)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]propanoyl]pyrrolidin-1-yl]-1-oxo-3-sulfanylpropan-2-yl]-2,3-dihydroinden-1-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "2-[(2R)-1-[(2S,4R)-4-hydroxy-2-[3-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]propanoyl]pyrrolidin-1-yl]-1-oxo-3-sulfanylpropan-2-yl]-2,3-dihydroinden-1-one", "role": "assistant" } ]
297,129
{ "selfies": "[C][C][Branch1][P][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1][N][Ring1][Branch1][C][#N]", "smiles": "CC(CC(=O)c1cccc(Br)c1)C(=O)NC1CC2CCC1N2C#N" }
4-(3-bromophenyl)-N-(7-cyano-7-azabicyclo[2.2.1]heptan-2-yl)-2-methyl-4-oxobutanamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "4-(3-bromophenyl)-N-(7-cyano-7-azabicyclo[2.2.1]heptan-2-yl)-2-methyl-4-oxobutanamide", "role": "assistant" } ]
297,130
{ "selfies": "[C][C][=Branch1][C][=O][C][C][=C][C][Branch2][Ring2][=Branch2][O][C][=C][C][=C][N][=C][Branch2][Ring1][Ring1][N][C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][O][N][=Ring1][=Branch2][N][Branch1][C][C][C][Ring1][S][=C][Ring2][Ring1][Ring2][C][=C][C][=N][Ring2][Ring1][N]", "smiles": "CC(=O)Cc1cc(Oc2ccc3nc(Nc4cc(C(C)(C)C)on4)n(C)c3c2C)ccn1" }
1-[4-[2-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-3,4-dimethylbenzimidazol-5-yl]oxypyridin-2-yl]propan-2-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "1-[4-[2-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-3,4-dimethylbenzimidazol-5-yl]oxypyridin-2-yl]propan-2-one", "role": "assistant" } ]
297,132
{ "selfies": "[C][C][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][Branch2][=Branch2][=Branch2][C][=Branch1][C][=O][C][C][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][C][C][Branch2][=Branch1][P][C][=Branch1][C][=O][N][C][Branch2][=Branch1][C][C][=Branch1][C][=O][C][C][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][Branch1][#Branch1][C][Branch1][C][C][C][C][C][=Branch1][C][=O][O][C][Ring2][Ring1][N][C][C][Branch1][C][C][C][C][C][Branch1][C][C][C][C][C][Branch1][C][C][C][C]", "smiles": "CCC(Cc1ccccc1)C(=O)NC(C(=O)CC(CO)C(=O)NC(CCC(N)=O)C(=O)CC(C(=O)NC(C(=O)CC(CO)C(=O)NC1C(=O)CC(C)C(=O)NC2(CCCCCC2)C(=O)NC(C(C)CC)C(=O)OC1C)C(C)CC)C(C)CC)C(C)CC" }
(2R,5R)-5-[[(2S,5S,6S)-5-[[(2R)-2-benzylbutanoyl]amino]-2-(hydroxymethyl)-6-methyl-4-oxooctanoyl]amino]-2-[(2S)-butan-2-yl]-N-[(3S,4S,7S)-8-[[(10R,13R,14S,17S)-17-[(2S)-butan-2-yl]-10,14-dimethyl-9,12,16,19-tetraoxo-15-oxa-8,18-diazaspiro[6.12]nonadecan-13-yl]amino]-7-(hydroxymethyl)-3-methyl-5,8-dioxooctan-4-yl]-4-oxooctanediamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "(2R,5R)-5-[[(2S,5S,6S)-5-[[(2R)-2-benzylbutanoyl]amino]-2-(hydroxymethyl)-6-methyl-4-oxooctanoyl]amino]-2-[(2S)-butan-2-yl]-N-[(3S,4S,7S)-8-[[(10R,13R,14S,17S)-17-[(2S)-butan-2-yl]-10,14-dimethyl-9,12,16,19-tetraoxo-15-oxa-8,18-diazaspiro[6.12]nonadecan-13-yl]amino]-7-(hydroxymethyl)-3-methyl-5,8-dioxooctan-4-yl]-4-oxooctanediamide", "role": "assistant" } ]
297,134
{ "selfies": "[C][=C][C][C][C][Branch1][=Branch1][N][Branch1][C][C][C][C][Branch1][C][O][C][Branch2][Branch1][O][O][C][C][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][C][C][C][C][O][C][Ring1][O][Branch1][C][C][C][C][Branch1][C][C][C][N][C][Branch1][C][C][C][C][C][=Branch1][C][=O][O][C][Ring1][=Branch1][Branch1][C][C][C][Branch1][Ring1][C][C][O][C][Ring2][Ring1][#Branch2][=O][O][Ring2][Ring2][O]", "smiles": "C=CC1CC(N(C)C)C(O)C(OC2C(C)C(=O)C3(C)CCOC2(C)CC(C)CNC(C)C2CC(=O)OC2(C)C(CC)OC3=O)O1" }
(1S,4R,5S,9R,10R,13R,15R,20R,21R)-21-[(2S)-4-(dimethylamino)-6-ethenyl-3-hydroxyoxan-2-yl]oxy-4-ethyl-1,5,10,13,15,20-hexamethyl-3,6,16-trioxa-11-azatricyclo[13.3.3.05,9]henicosane-2,7,19-trione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Turn the given SMILES symbol of a molecule <molecule_2d> into its respective IUPAC name.", "role": "user" }, { "content": "(1S,4R,5S,9R,10R,13R,15R,20R,21R)-21-[(2S)-4-(dimethylamino)-6-ethenyl-3-hydroxyoxan-2-yl]oxy-4-ethyl-1,5,10,13,15,20-hexamethyl-3,6,16-trioxa-11-azatricyclo[13.3.3.05,9]henicosane-2,7,19-trione", "role": "assistant" } ]
297,136
{ "selfies": "[O][=C][Branch2][Ring1][#Branch2][C][C][C][O][C][C][O][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C][C][C][Ring1][=Branch1][=O][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][#C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][S]", "smiles": "O=C(CCCOCCOCCC(=O)ON1C(=O)CCC1=O)CCC(=O)N1Cc2ccccc2C#Cc2ccccc21" }
(2,5-dioxopyrrolidin-1-yl) 3-[2-[7-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-4,7-dioxoheptoxy]ethoxy]propanoate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "(2,5-dioxopyrrolidin-1-yl) 3-[2-[7-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-4,7-dioxoheptoxy]ethoxy]propanoate", "role": "assistant" } ]
297,139
{ "selfies": "[C][C][=C][C][=C][Branch1][Branch2][C][=N][C][=C][NH1][Ring1][Branch1][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][C]", "smiles": "Cc1ccc(-c2ncc[nH]2)c(Cc2ccccc2)c1" }
2-(2-benzyl-4-methylphenyl)-1H-imidazole
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .", "role": "user" }, { "content": "2-(2-benzyl-4-methylphenyl)-1H-imidazole", "role": "assistant" } ]
297,141
{ "selfies": "[C][O][C][C][N][C][=Branch1][C][=O][O][C][C][C][Branch2][Branch1][#Branch2][C][O][C][=N][C][Branch1][#C][N][C][C][C][C][C][Branch1][Ring2][C][Ring1][Branch1][C][Ring1][Branch2][=C][C][=N][C][Branch2][Ring1][C][C][=C][C][=C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][O][Ring1][#Branch1][=C][Branch1][C][F][C][Ring2][Ring1][C][=N][Ring2][Ring1][=C][N][Branch1][C][C][C][Ring2][Ring2][=Branch1]", "smiles": "COCCNC(=O)OC1CC(COc2nc(N3CC4CCC(C4)C3)c3cnc(-c4cccc5cccc(Cl)c45)c(F)c3n2)N(C)C1" }
[(3R,5S)-5-[[4-(3-azabicyclo[3.2.1]octan-3-yl)-7-(8-chloronaphthalen-1-yl)-8-fluoropyrido[4,3-d]pyrimidin-2-yl]oxymethyl]-1-methylpyrrolidin-3-yl] N-(2-methoxyethyl)carbamate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "[(3R,5S)-5-[[4-(3-azabicyclo[3.2.1]octan-3-yl)-7-(8-chloronaphthalen-1-yl)-8-fluoropyrido[4,3-d]pyrimidin-2-yl]oxymethyl]-1-methylpyrrolidin-3-yl] N-(2-methoxyethyl)carbamate", "role": "assistant" } ]
297,146
{ "selfies": "[C][C][Branch2][Ring2][#Branch2][C][O][C][Branch2][Ring1][=C][N][C][=N][C][=C][Branch1][=C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][N][=C][Ring1][#C][Ring2][Ring1][C][C][C][Ring2][Ring1][#Branch1][O][C][C][Ring2][Ring1][O]", "smiles": "CC1(C2OC(n3cnc4c(NC(=O)c5ccccc5)ncnc43)CC2O)CC1" }
N-[9-[(2R,4R,5R)-4-hydroxy-5-(1-methylcyclopropyl)oxolan-2-yl]purin-6-yl]benzamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "N-[9-[(2R,4R,5R)-4-hydroxy-5-(1-methylcyclopropyl)oxolan-2-yl]purin-6-yl]benzamide", "role": "assistant" } ]
297,148
{ "selfies": "[C][S][C][=C][Branch1][C][Cl][C][=C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=C][N][Branch1][C][C][C][C][C][Branch1][C][C][C][Ring1][Branch1][N][=C][Ring1][=N][N][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][Ring2][Ring1][O][=Ring2][Ring1][=Branch1]", "smiles": "CSc1c(Cl)ccc2c(=O)c3ccc(N(C)C4CC(C)C4)nc3n(CC(=O)O)c12" }
2-[8-chloro-2-[methyl-(3-methylcyclobutyl)amino]-9-methylsulfanyl-5-oxobenzo[b][1,8]naphthyridin-10-yl]acetic acid
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "2-[8-chloro-2-[methyl-(3-methylcyclobutyl)amino]-9-methylsulfanyl-5-oxobenzo[b][1,8]naphthyridin-10-yl]acetic acid", "role": "assistant" } ]
297,149
{ "selfies": "[O][=C][Branch2][Ring1][Branch2][N][C][C][=C][Branch1][C][F][C][=Branch1][C][=O][N][Branch1][#Branch1][C][C][Branch1][C][F][F][C][=Ring1][N][C][=C][C][Branch1][O][C][#C][C][=C][N][=C][N][=C][Ring1][=Branch1][=C][Branch1][C][Cl][S][Ring1][=C]", "smiles": "O=C(Nc1cc(F)c(=O)n(CC(F)F)c1)c1cc(C#Cc2cncnc2)c(Cl)s1" }
5-chloro-N-[1-(2,2-difluoroethyl)-5-fluoro-6-oxopyridin-3-yl]-4-(2-pyrimidin-5-ylethynyl)thiophene-2-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "5-chloro-N-[1-(2,2-difluoroethyl)-5-fluoro-6-oxopyridin-3-yl]-4-(2-pyrimidin-5-ylethynyl)thiophene-2-carboxamide", "role": "assistant" } ]
297,152
{ "selfies": "[O][=C][Branch1][P][C][C][Branch1][Ring2][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][S][C][C][N][Ring1][Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N]", "smiles": "O=C(CC(CCO)c1ccccc1F)C1SCCN1S(=O)(=O)c1ccc(-c2ccccc2)cc1" }
3-(2-fluorophenyl)-5-hydroxy-1-[3-(4-phenylphenyl)sulfonyl-1,3-thiazolidin-2-yl]pentan-1-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "3-(2-fluorophenyl)-5-hydroxy-1-[3-(4-phenylphenyl)sulfonyl-1,3-thiazolidin-2-yl]pentan-1-one", "role": "assistant" } ]
297,156
{ "selfies": "[C][C][O][C][=C][C][Branch1][C][F][=C][Branch2][Ring2][Ring2][C][C][NH1][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][=Ring1][#Branch2][C][C][Branch1][C][C][N][Ring1][#C][C][C][Branch1][C][C][Branch1][C][F][C][O][C][Branch1][C][F][=C][Ring2][Ring1][=N]", "smiles": "CCOc1cc(F)c(C2c3[nH]c4cc(F)ccc4c3CC(C)N2CC(C)(F)CO)c(F)c1" }
3-[1-(4-ethoxy-2,6-difluorophenyl)-7-fluoro-3-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-2-fluoro-2-methylpropan-1-ol
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.", "role": "user" }, { "content": "3-[1-(4-ethoxy-2,6-difluorophenyl)-7-fluoro-3-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-2-fluoro-2-methylpropan-1-ol", "role": "assistant" } ]
297,158
{ "selfies": "[C][N][C][=C][C][Branch2][Ring1][#Branch1][C][=C][N][Branch1][Branch2][C][C][C][O][C][Ring1][Branch1][C][=N][C][=C][C][=C][Ring1][=C][Ring1][=Branch1][=N][C][=C][Branch1][=C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][O][C][=N][N][Ring2][Ring1][S][Ring1][=C]", "smiles": "CNc1cc(-c2cn(C3CCOC3)c3ncccc23)nc2c(C(=O)NC3CCCC3O)cnn12" }
N-[(1R,2S)-2-hydroxycyclopentyl]-7-(methylamino)-5-[1-[(3R)-oxolan-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "N-[(1R,2S)-2-hydroxycyclopentyl]-7-(methylamino)-5-[1-[(3R)-oxolan-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide", "role": "assistant" } ]
297,162
{ "selfies": "[C][C][N][C][Branch2][Ring1][#C][C][=C][C][Branch1][S][N][C][C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][Ring1][=Branch2][=C][N][=C][Ring1][#C][C][Branch1][C][C][C][=C][C][=C][C][=Branch1][=Branch2][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][O][C][=C][S][C][=Branch1][Ring2][=N][Ring1][Branch1][C][C][Branch2][Ring2][S][N][C][=Branch1][C][=O][C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][N][C][C][C][Branch2][Ring1][#Branch1][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][N][C][Ring1][Ring1][C][C][C][Ring1][Ring1][C][Ring1][=N][C][Ring1][P][C][=Branch1][C][=O][N][C][C][C][C][Branch1][Ring2][N][Ring1][=Branch1][C][=Branch1][C][=O][O][C][C][Branch1][C][C][Branch1][C][C][C][Ring2][Branch1][Branch2]", "smiles": "CCn1c(-c2cc(N3CCN(C4CC4)CC3)cnc2C(C)C)c2c3cc(ccc31)-c1csc(n1)CC(NC(=O)C(C1CCCC1)N1CCC3(CCN(C(=O)C4NC4C4CC4)C3)C1)C(=O)N1CCCC(N1)C(=O)OCC(C)(C)C2" }
(2S)-2-cyclopentyl-2-[(5S)-2-[(2R,3R)-3-cyclopropylaziridine-2-carbonyl]-2,7-diazaspiro[4.4]nonan-7-yl]-N-[(7S,13S)-20-[5-(4-cyclopropylpiperazin-1-yl)-2-propan-2-ylpyridin-3-yl]-21-ethyl-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,27,28-tetrazapentacyclo[17.5.2.12,5.19,13.022,26]octacosa-1(25),2,5(28),19,22(26),23-hexaen-7-yl]acetamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "(2S)-2-cyclopentyl-2-[(5S)-2-[(2R,3R)-3-cyclopropylaziridine-2-carbonyl]-2,7-diazaspiro[4.4]nonan-7-yl]-N-[(7S,13S)-20-[5-(4-cyclopropylpiperazin-1-yl)-2-propan-2-ylpyridin-3-yl]-21-ethyl-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,27,28-tetrazapentacyclo[17.5.2.12,5.19,13.022,26]octacosa-1(25),2,5(28),19,22(26),23-hexaen-7-yl]acetamide", "role": "assistant" } ]
297,165
{ "selfies": "[C][C][=C][N][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][=C][C][Branch1][C][C][S][C][=N][N][=C][N][Ring1][Branch1][C][=C][Ring1][#C][C][=C][Ring2][Ring1][Branch2][C][C][C][Ring1][Ring1]", "smiles": "Cc1cnc(C(=O)Cc2cccc(C(C)Sc3nncn3C)c2)cc1C1CC1" }
1-(4-cyclopropyl-5-methylpyridin-2-yl)-2-[3-[(1S)-1-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]phenyl]ethanone
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "1-(4-cyclopropyl-5-methylpyridin-2-yl)-2-[3-[(1S)-1-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]phenyl]ethanone", "role": "assistant" } ]
297,166
{ "selfies": "[C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][Branch1][C][=C][N][=C][C][Branch2][Ring1][=Branch2][N][C][C][C][Branch1][C][O][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring1][=C][=N][Ring2][Ring1][Ring2][C][=C][Ring2][Ring1][#Branch2]", "smiles": "CCC(=O)c1ccc(-c2cncc(N3CCC(O)(c4ccc(F)cc4)CC3)n2)cc1" }
1-[4-[6-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]pyrazin-2-yl]phenyl]propan-1-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .", "role": "user" }, { "content": "1-[4-[6-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]pyrazin-2-yl]phenyl]propan-1-one", "role": "assistant" } ]
297,167
{ "selfies": "[C][C][C][C][C][C][N][C][=Branch1][C][=O][C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][=Branch1][C][=O][C][C][Branch2][Branch1][Branch2][C][C][=Branch1][C][=O][C][C][Branch2][Ring2][Branch1][C][C][=Branch1][C][=O][N][C][C][N][C][C][N][C][Branch2][Ring1][C][C][O][C][=Branch1][C][=O][O][C][C][C][N][Branch1][Ring1][C][C][C][C][N][C][=O][C][=Branch1][C][=O][N][C][C][C][C][C][=Branch1][C][=O][N][C][C][N][C][C][N][C][Branch2][Ring1][C][C][O][C][=Branch1][C][=O][O][C][C][C][N][Branch1][Ring1][C][C][C][C][C][Branch1][C][N][=O]", "smiles": "CCCCCCNC(=O)CC(NC(=O)CC(CC)C(=O)NCCCCCC)C(=O)CC(CC(=O)CC(CC(=O)NCCNCCNC(COC(=O)OCCCN(CC)CC)NC=O)C(=O)NCCCC)C(=O)NCCNCCNC(COC(=O)OCCCN(CC)CC)C(N)=O" }
[3-amino-2-[2-[2-[[6-(butylcarbamoyl)-8-[2-[2-[[2-[3-(diethylamino)propoxycarbonyloxy]-1-formamidoethyl]amino]ethylamino]ethylamino]-2-[5-(hexylamino)-3-[3-(hexylcarbamoyl)pentanoylamino]-2,5-dioxopentyl]-4,8-dioxooctanoyl]amino]ethylamino]ethylamino]-3-oxopropyl] 3-(diethylamino)propyl carbonate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the SMILES representation of a molecule <molecule_2d> into IUPAC name.", "role": "user" }, { "content": "[3-amino-2-[2-[2-[[6-(butylcarbamoyl)-8-[2-[2-[[2-[3-(diethylamino)propoxycarbonyloxy]-1-formamidoethyl]amino]ethylamino]ethylamino]-2-[5-(hexylamino)-3-[3-(hexylcarbamoyl)pentanoylamino]-2,5-dioxopentyl]-4,8-dioxooctanoyl]amino]ethylamino]ethylamino]-3-oxopropyl] 3-(diethylamino)propyl carbonate", "role": "assistant" } ]
297,168
{ "selfies": "[C][C][Branch2][Branch1][N][C][C][C][C][Branch1][C][C][C][C][C][C][C][C][Branch1][C][O][C][C][C][C][Branch1][#C][N][C][C][C][N][C][C][C][C][C][C][C][C][N][C][C][C][Ring2][Ring1][Ring2][Branch1][C][C][C][Ring2][Ring1][#Branch2][C][C][C][Ring2][Ring1][P][Ring2][Ring1][=C][C][C][=Branch1][C][=O][O]", "smiles": "CC(CCCC(C)C1CCC2C3C(O)CC4CC(NCCCNCCCCCCCCN)CCC4(C)C3CCC12C)C(=O)O" }
(6R)-6-[(3S,5R,10S,13R,17R)-3-[3-(8-aminooctylamino)propylamino]-7-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylheptanoic acid
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "(6R)-6-[(3S,5R,10S,13R,17R)-3-[3-(8-aminooctylamino)propylamino]-7-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylheptanoic acid", "role": "assistant" } ]
297,172
{ "selfies": "[C][N][Branch1][C][C][C][C][C][Branch2][=C][#Branch2][O][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][C][Branch2][Branch1][#Branch1][C][C][=Branch1][C][=O][C][Branch2][Ring1][S][C][C][C][C][N][C][=Branch1][C][=O][O][C][Branch1][Branch2][C][C][N][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][N][=N+1][=N-1][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][Branch2][Branch1][#Branch1][C][C][=Branch1][C][=O][C][Branch2][Ring1][S][C][C][C][C][N][C][=Branch1][C][=O][O][C][Branch1][Branch2][C][C][N][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][N][=N+1][=N-1][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][C][Branch2][Ring1][S][C][C][C][C][N][C][=Branch1][C][=O][O][C][Branch1][Branch2][C][C][N][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][N][=N+1][=N-1][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][N][=N+1][=N-1]", "smiles": "CN(C)CCC(OC(=O)NCCCCC(NC(=O)OC(C)(C)C)C(=O)CC(CC(=O)C(CCCCNC(=O)OC(CCN(C)C)C(C)(C)CN=[N+]=[N-])NC(=O)OC(C)(C)C)(CC(=O)C(CCCCNC(=O)OC(CCN(C)C)C(C)(C)CN=[N+]=[N-])NC(=O)OC(C)(C)C)CC(=O)C(CCCCNC(=O)OC(CCN(C)C)C(C)(C)CN=[N+]=[N-])NC(=O)OC(C)(C)C)C(C)(C)CN=[N+]=[N-]" }
[1-azido-5-(dimethylamino)-2,2-dimethylpentan-3-yl] N-[(5S,11S)-15-[[1-azido-5-(dimethylamino)-2,2-dimethylpentan-3-yl]oxycarbonylamino]-8,8-bis[(3S)-7-[[1-azido-5-(dimethylamino)-2,2-dimethylpentan-3-yl]oxycarbonylamino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxoheptyl]-5,11-bis[(2-methylpropan-2-yl)oxycarbonylamino]-6,10-dioxopentadecyl]carbamate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "[1-azido-5-(dimethylamino)-2,2-dimethylpentan-3-yl] N-[(5S,11S)-15-[[1-azido-5-(dimethylamino)-2,2-dimethylpentan-3-yl]oxycarbonylamino]-8,8-bis[(3S)-7-[[1-azido-5-(dimethylamino)-2,2-dimethylpentan-3-yl]oxycarbonylamino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxoheptyl]-5,11-bis[(2-methylpropan-2-yl)oxycarbonylamino]-6,10-dioxopentadecyl]carbamate", "role": "assistant" } ]
297,173
{ "selfies": "[C][N][C][=C][C][Branch2][Ring1][Branch2][C][=C][N][=C][C][=C][Branch1][=Branch2][O][C][C][N][Branch1][C][C][C][C][=C][N][Ring1][#C][Ring1][N][=C][C][Branch1][#Branch1][O][C][Branch1][C][F][F][=C][Ring2][Ring1][=Branch2][C][=Branch1][C][=O][C][C][C][Branch1][C][F][Branch1][C][F][F]", "smiles": "CNc1cc(-c2cnc3cc(OCCN(C)C)ccn23)cc(OC(F)F)c1C(=O)CCC(F)(F)F" }
1-[2-(difluoromethoxy)-4-[7-[2-(dimethylamino)ethoxy]imidazo[1,2-a]pyridin-3-yl]-6-(methylamino)phenyl]-4,4,4-trifluorobutan-1-one
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "1-[2-(difluoromethoxy)-4-[7-[2-(dimethylamino)ethoxy]imidazo[1,2-a]pyridin-3-yl]-6-(methylamino)phenyl]-4,4,4-trifluorobutan-1-one", "role": "assistant" } ]
297,174
{ "selfies": "[F][C][=C][C][Branch1][=N][C][C][C][C][C][N][C][=C][N][=C][Ring1][Branch1][=C][C][=N][Ring1][S]", "smiles": "Fc1cc(CCCCCn2ccnc2)ccn1" }
2-fluoro-4-(5-imidazol-1-ylpentyl)pyridine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "2-fluoro-4-(5-imidazol-1-ylpentyl)pyridine", "role": "assistant" } ]
297,175
{ "selfies": "[C][C][C][C][Branch1][#C][C][N][C][Branch1][C][O][C][=C][C][N][Branch1][C][C][C][C][C][Branch1][C][O][C][=C][C][=C][C][Branch2][Ring1][S][N][=C][Branch1][C][N][N][N][=C][C][Branch1][=Branch1][C][Branch1][C][C][C][=C][Ring1][Branch2][N][=C][O][C][Branch1][Ring1][C][C][C][C][N][C][=C][Ring2][Ring1][O]", "smiles": "CCCC(CNC(O)C=CCN(C)C)CC(O)c1cccc(N=C(N)n2ncc(C(C)C)c2N=COC(CC)CCNC)c1" }
1-(methylamino)pentan-3-yl N-[2-[N'-[3-[3-[[[(E)-4-(dimethylamino)-1-hydroxybut-2-enyl]amino]methyl]-1-hydroxyhexyl]phenyl]carbamimidoyl]-4-propan-2-ylpyrazol-3-yl]methanimidate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "1-(methylamino)pentan-3-yl N-[2-[N'-[3-[3-[[[(E)-4-(dimethylamino)-1-hydroxybut-2-enyl]amino]methyl]-1-hydroxyhexyl]phenyl]carbamimidoyl]-4-propan-2-ylpyrazol-3-yl]methanimidate", "role": "assistant" } ]
297,181
{ "selfies": "[C][C][C][S][S][C][Branch1][=Branch2][C][=Branch1][C][=O][N][Ring1][#Branch1][C][C][Branch1][C][O][C][Branch2][Ring2][=C][C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][N][C][Ring1][#Branch2][N][C][=Branch1][C][=O][C][Branch1][C][C][S][S][C][Ring1][Branch2][Branch1][=Branch2][C][=Branch1][C][=O][N][Ring1][Branch2][C][C][Ring2][Ring1][#Branch1][O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][C][Ring2][Ring2][C][N][Ring2][Ring2][#Branch2][C][Ring2][Ring2][=C][=O]", "smiles": "CCC12SSC3(C(=O)N1C)C(O)C1(C45c6cc(F)ccc6NC4N4C(=O)C6(C)SSC4(C(=O)N6C)C5O)c4cc(F)ccc4CC1N3C2=O" }
(1S,2S,3S,11R,14S)-3-[(1S,2S,3S,11S,14S)-14-ethyl-6-fluoro-2-hydroxy-18-methyl-13,17-dioxo-15,16-dithia-12,18-diazapentacyclo[12.2.2.01,12.03,11.04,9]octadeca-4(9),5,7-trien-3-yl]-6-fluoro-2-hydroxy-14,18-dimethyl-15,16-dithia-10,12,18-triazapentacyclo[12.2.2.01,12.03,11.04,9]octadeca-4(9),5,7-triene-13,17-dione
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Please write the IUPAC name of the molecule <molecule_2d> .", "role": "user" }, { "content": "(1S,2S,3S,11R,14S)-3-[(1S,2S,3S,11S,14S)-14-ethyl-6-fluoro-2-hydroxy-18-methyl-13,17-dioxo-15,16-dithia-12,18-diazapentacyclo[12.2.2.01,12.03,11.04,9]octadeca-4(9),5,7-trien-3-yl]-6-fluoro-2-hydroxy-14,18-dimethyl-15,16-dithia-10,12,18-triazapentacyclo[12.2.2.01,12.03,11.04,9]octadeca-4(9),5,7-triene-13,17-dione", "role": "assistant" } ]
297,185
{ "selfies": "[C][C][C][C][O][C][Branch2][Ring2][=Branch1][C][Branch2][Ring1][=C][N][C][=N][C][=C][Branch1][=C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][N][=C][Ring1][#C][Ring2][Ring1][C][O][Ring2][Ring1][Branch2][C][Ring2][Ring1][=Branch2][O]", "smiles": "CCC12COC(C(n3cnc4c(NC(=O)c5ccccc5)ncnc43)O1)C2O" }
N-[9-[(1S,3S,4R,7S)-1-ethyl-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-3-yl]purin-6-yl]benzamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.", "role": "user" }, { "content": "N-[9-[(1S,3S,4R,7S)-1-ethyl-7-hydroxy-2,5-dioxabicyclo[2.2.1]heptan-3-yl]purin-6-yl]benzamide", "role": "assistant" } ]
297,190
{ "selfies": "[O][=N+1][Branch1][C][O-1][C][=C][C][Branch1][C][Cl][=C][C][Branch2][Ring1][=Branch2][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][O][C][C][Ring1][Branch1][=C][Ring2][Ring1][Branch1][O]", "smiles": "O=[N+]([O-])c1cc(Cl)cc(CS(=O)(=O)c2cc(Br)cc3c2OCC3)c1O" }
2-[(5-bromo-2,3-dihydro-1-benzofuran-7-yl)sulfonylmethyl]-4-chloro-6-nitrophenol
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Can you give the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "2-[(5-bromo-2,3-dihydro-1-benzofuran-7-yl)sulfonylmethyl]-4-chloro-6-nitrophenol", "role": "assistant" } ]
297,194
{ "selfies": "[C][O][C][=C][C][Branch1][S][N][C][C][C][Branch1][=Branch1][N][Branch1][C][C][C][C][C][Ring1][=Branch2][=C][C][=C][Ring1][#C][C][C][=N][C][Branch1][C][C][=C][Branch1][C][Cl][C][Branch2][Ring1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][P][Branch1][C][C][Branch1][C][C][=O][=N][Ring2][Ring1][Ring1]", "smiles": "COc1cc(N2CCC(N(C)C)CC2)ccc1Cc1nc(C)c(Cl)c(Cc2ccccc2P(C)(C)=O)n1" }
1-[4-[[5-chloro-4-[(2-dimethylphosphorylphenyl)methyl]-6-methylpyrimidin-2-yl]methyl]-3-methoxyphenyl]-N,N-dimethylpiperidin-4-amine
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "1-[4-[[5-chloro-4-[(2-dimethylphosphorylphenyl)methyl]-6-methylpyrimidin-2-yl]methyl]-3-methoxyphenyl]-N,N-dimethylpiperidin-4-amine", "role": "assistant" } ]
297,197
{ "selfies": "[C][C][C][C][C][C][C][=C][Branch1][=N][C][=C][C][=C][C][=C][N][=C][Ring1][#Branch2][Ring1][=Branch1][O][Ring1][#C]", "smiles": "CCC1CCCc2c(ccc3cccnc23)O1" }
(8R)-8-ethyl-8,9,10,11-tetrahydrooxepino[2,3-h]quinoline
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Please write the IUPAC name of the molecule <molecule_2d> .", "role": "user" }, { "content": "(8R)-8-ethyl-8,9,10,11-tetrahydrooxepino[2,3-h]quinoline", "role": "assistant" } ]
297,198
{ "selfies": "[O][=C][Branch2][Ring2][=N][N][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][S][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]", "smiles": "O=C(NC(Cc1ccccc1)C(=O)Cc1ccc(S(=O)(=O)NC2CCOCC2)cc1)c1ccc(F)cc1" }
4-fluoro-N-[(2S)-4-[4-(oxan-4-ylsulfamoyl)phenyl]-3-oxo-1-phenylbutan-2-yl]benzamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "4-fluoro-N-[(2S)-4-[4-(oxan-4-ylsulfamoyl)phenyl]-3-oxo-1-phenylbutan-2-yl]benzamide", "role": "assistant" } ]
297,202
{ "selfies": "[C][N][Branch1][C][C][C][=C][C][=C][C][=C][Branch2][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][O][C][=Branch1][C][=O][C][Branch1][C][N][C][S][C][=C][C][=C][Ring2][Ring1][Branch2][Ring2][Ring1][Ring2]", "smiles": "CN(C)c1cccc2c(S(=O)(=O)NCCCOC(=O)C(N)CS)cccc12" }
3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propyl 2-amino-3-sulfanylpropanoate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?", "role": "user" }, { "content": "3-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]propyl 2-amino-3-sulfanylpropanoate", "role": "assistant" } ]
297,208
{ "selfies": "[C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][N][C][=N][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][C][C][N][=C][Ring1][#Branch1][=C][C][Ring1][S][C][=C][Ring2][Ring1][=Branch1]", "smiles": "CCC(=O)N(C)c1ccc(C2=NC(C(=O)NCc3ccc(C)nc3)=CC2)cc1" }
2-[4-[methyl(propanoyl)amino]phenyl]-N-[(6-methylpyridin-3-yl)methyl]-3H-pyrrole-5-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .", "role": "user" }, { "content": "2-[4-[methyl(propanoyl)amino]phenyl]-N-[(6-methylpyridin-3-yl)methyl]-3H-pyrrole-5-carboxamide", "role": "assistant" } ]
297,209
{ "selfies": "[C][C][C][N][C][=N][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][O][C][=C][C][Branch1][#C][N][C][C][C][C][C][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][=C][C][=C][Ring1][=C][C][Ring2][Ring1][C][C][=C][Ring2][Ring1][O][C][Ring2][Ring1][#C][C][Ring2][Ring1][S]", "smiles": "CC12CNc3ncc(C(=O)NC4COc5cc(N6CC7CCC(C6)N7)ccc5C4)cc3C1C2" }
(1aS,7bR)-N-[(3R)-7-(3,8-diazabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-3-yl]-1a-methyl-1,2,3,7b-tetrahydrocyclopropa[c][1,8]naphthyridine-6-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "(1aS,7bR)-N-[(3R)-7-(3,8-diazabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-3-yl]-1a-methyl-1,2,3,7b-tetrahydrocyclopropa[c][1,8]naphthyridine-6-carboxamide", "role": "assistant" } ]
297,210
{ "selfies": "[C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][O][C][=C][N][C][=Branch1][Ring2][=N][Ring1][Branch1][S][C][=C][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][C][C][Branch1][C][O][C][Ring1][Branch1][Branch1][C][C][C][=C][C][=C][Ring1][S][Ring2][Ring1][Ring2][C][=C][Ring2][Ring1][N]", "smiles": "CNC(=O)c1ccc(-c2cn3c(n2)sc2cc(C(=O)CC4CC(O)C4(C)C)ccc23)cc1" }
4-[6-[2-(3-hydroxy-2,2-dimethylcyclobutyl)acetyl]imidazo[2,1-b][1,3]benzothiazol-2-yl]-N-methylbenzamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "4-[6-[2-(3-hydroxy-2,2-dimethylcyclobutyl)acetyl]imidazo[2,1-b][1,3]benzothiazol-2-yl]-N-methylbenzamide", "role": "assistant" } ]
297,211
{ "selfies": "[C][C][C][Branch1][Ring1][C][#N][C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][=Branch2][C][=N][C][Branch1][=C][N][C][C][=N][N][Branch1][Ring2][C][C][O][C][=Ring1][Branch2][=N][C][=C][Ring1][#C][C][C][=C][Ring2][Ring1][=Branch1]", "smiles": "CCC(C#N)CC(=O)c1ccc(-c2nc(Nc3cnn(CCO)c3)ncc2C)cc1" }
(2R)-2-ethyl-4-[4-[2-[[1-(2-hydroxyethyl)pyrazol-4-yl]amino]-5-methylpyrimidin-4-yl]phenyl]-4-oxobutanenitrile
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Please write the IUPAC name of the molecule <molecule_2d> .", "role": "user" }, { "content": "(2R)-2-ethyl-4-[4-[2-[[1-(2-hydroxyethyl)pyrazol-4-yl]amino]-5-methylpyrimidin-4-yl]phenyl]-4-oxobutanenitrile", "role": "assistant" } ]
297,218
{ "selfies": "[C][=C][N][C][=C][Branch1][C][Cl][C][=C][C][=C][Branch1][#C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][O][C][Ring1][=Branch1][O][C][Ring1][=N][=C][Ring2][Ring1][C][C][Branch1][Branch2][C][C][C][C][C][Ring1][=Branch1][N][Ring2][Ring1][O]", "smiles": "C=C1Nc2c(Cl)cc3cc(C(=O)N4CCC(O)C4)oc3c2C2(CCCCC2)N1" }
(5-chloro-7-methylidenespiro[6,8-dihydrofuro[2,3-f]quinazoline-9,1'-cyclohexane]-2-yl)-(3-hydroxypyrrolidin-1-yl)methanone
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Turn the given SMILES symbol of a molecule <molecule_2d> into its respective IUPAC name.", "role": "user" }, { "content": "(5-chloro-7-methylidenespiro[6,8-dihydrofuro[2,3-f]quinazoline-9,1'-cyclohexane]-2-yl)-(3-hydroxypyrrolidin-1-yl)methanone", "role": "assistant" } ]
297,219
{ "selfies": "[C][O][C][C][O][C][C][O][C][C][O][C][C][N][Branch2][#Branch1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=N][C][=C][Branch2][Branch1][Branch2][N][=C][N][Ring1][Branch1][C][O][C][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C][C][C][Branch1][#Branch2][O][C][=C][C][=N][C][=N][Ring1][=Branch1][C][C][Ring1][N][C][O][P][=Branch1][C][=O][Branch1][C][S][O][C][Ring2][Ring1][N][C][Ring2][Ring1][O][O][C][=Branch1][C][=O][NH1][Ring2][Ring2][Branch2][C][=Branch1][C][=O][O][C][C][=C][C][=C][Branch2][Ring2][=N][C][C][=Branch1][C][=O][C][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][C][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][Ring1][=Branch1][=O][C][Branch1][C][C][C][C][=C][Ring2][Ring1][P]", "smiles": "COCCOCCOCCOCCN(Cc1ccccc1C(=O)Nc1nc2c(ncn2C2OC3COP(O)(=S)OC4CC(Oc5ccncn5)CC4COP(=O)(S)OC2C3O)c(=O)[nH]1)C(=O)OCc1ccc(CC(=O)C(C)NC(=O)C(CC(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)cc1" }
[4-[(3S)-3-[[(2S)-9-(2,5-dioxopyrrol-1-yl)-4-oxo-2-propan-2-ylnonanoyl]amino]-2-oxobutyl]phenyl]methyl N-[[2-[[9-[(1R,6R,8R,10S,15R,17R,18R)-12,18-dihydroxy-3-oxo-8-pyrimidin-4-yloxy-3-sulfanyl-12-sulfanylidene-2,4,11,13,16-pentaoxa-3lambda5,12lambda5-diphosphatricyclo[13.2.1.06,10]octadecan-17-yl]-6-oxo-1H-purin-2-yl]carbamoyl]phenyl]methyl]-N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]carbamate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .", "role": "user" }, { "content": "[4-[(3S)-3-[[(2S)-9-(2,5-dioxopyrrol-1-yl)-4-oxo-2-propan-2-ylnonanoyl]amino]-2-oxobutyl]phenyl]methyl N-[[2-[[9-[(1R,6R,8R,10S,15R,17R,18R)-12,18-dihydroxy-3-oxo-8-pyrimidin-4-yloxy-3-sulfanyl-12-sulfanylidene-2,4,11,13,16-pentaoxa-3lambda5,12lambda5-diphosphatricyclo[13.2.1.06,10]octadecan-17-yl]-6-oxo-1H-purin-2-yl]carbamoyl]phenyl]methyl]-N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]carbamate", "role": "assistant" } ]
297,221
{ "selfies": "[C][N][C][C][C][C][Ring1][Branch1][C][O][C][=N][C][Branch1][#C][N][C][C][C][C][C][Branch1][Ring2][C][Ring1][Branch1][C][Ring1][Branch2][=C][C][=N][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][N][Ring1][Branch2][=C][Branch1][C][F][C][Ring2][Ring1][Ring1][=N][Ring2][Ring1][#C]", "smiles": "CN1CCCC1COc1nc(N2CC3CCC(C3)C2)c2cnc(-c3cccc4cccc(C#N)c34)c(F)c2n1" }
8-[4-(3-azabicyclo[3.2.1]octan-3-yl)-8-fluoro-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]pyrido[4,3-d]pyrimidin-7-yl]naphthalene-1-carbonitrile
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Turn the given SMILES symbol of a molecule <molecule_2d> into its respective IUPAC name.", "role": "user" }, { "content": "8-[4-(3-azabicyclo[3.2.1]octan-3-yl)-8-fluoro-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]pyrido[4,3-d]pyrimidin-7-yl]naphthalene-1-carbonitrile", "role": "assistant" } ]
297,222
{ "selfies": "[C][C][=C][C][=C][Branch2][Ring2][=Branch2][C][=C][C][=C][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][=C][C][S][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=N][C][=Ring1][O][C][=N][Ring1][#C][=N][Ring2][Ring1][Branch2][C][=N][Ring2][Ring1][=C]", "smiles": "Cc1ccc(-c2cccc(C(=O)Nc3cc4sc(N5CCOCC5)nc4cn3)n2)cn1" }
6-(6-methylpyridin-3-yl)-N-(2-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-6-yl)pyridine-2-carboxamide
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "<molecule_2d> The above is a SMILES representation. Write the IUPAC name of the corresponding molecule.", "role": "user" }, { "content": "6-(6-methylpyridin-3-yl)-N-(2-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-6-yl)pyridine-2-carboxamide", "role": "assistant" } ]
297,223
{ "selfies": "[C][C][=Branch1][C][=O][O][C][C][O][C][Branch1][S][S][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Br][=C][Ring1][Branch2][C][Branch1][C][C][C][Branch1][Ring2][N][=N+1][=N-1][C][Ring2][Ring1][Ring1][O][C][Branch1][C][C][=O]", "smiles": "CC(=O)OCC1OC(Sc2ccc(F)c(Br)c2)C(C)C(N=[N+]=[N-])C1OC(C)=O" }
[(3R,5S,6R)-3-acetyloxy-4-azido-6-(3-bromo-4-fluorophenyl)sulfanyl-5-methyloxan-2-yl]methyl acetate
[ { "content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.", "role": "system" }, { "content": "Turn the given SMILES symbol of a molecule <molecule_2d> into its respective IUPAC name.", "role": "user" }, { "content": "[(3R,5S,6R)-3-acetyloxy-4-azido-6-(3-bromo-4-fluorophenyl)sulfanyl-5-methyloxan-2-yl]methyl acetate", "role": "assistant" } ]