id
int64
0
300k
molecules
dict
ground_truth
stringlengths
7
2.47k
messages
listlengths
3
3
297,228
{ "selfies": "[O][=C][C][C][N][Branch1][#C][C][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][=Branch1][C][=O][C][Ring1][P]", "smiles": "O=C1CCN(C2CNCc3ccccc32)C(=O)C1" }
1-(1,2,3,4-tetrahydroisoquinolin-4-yl)piperidine-2,4-dione
[ { "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-(1,2,3,4-tetrahydroisoquinolin-4-yl)piperidine-2,4-dione", "role": "assistant" } ]
297,229
{ "selfies": "[C][C][Branch1][C][C][C][=C][C][Branch2][Ring2][O][C][=C][C][=C][C][Branch2][Ring1][#C][C][=C][C][=C][C][=C][C][=Branch1][N][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][Ring1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=C][=C][Ring2][Ring1][Branch2][=C][C][=C][Ring2][Ring1][=C][C][=C][C][=C][Branch2][Ring1][O][C][=C][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=N][C][=C][Ring2][Ring1][=Branch1][Ring2][Branch1][=Branch1]", "smiles": "CC1(C)c2cc(-c3ccc4c(ccc5cc6c7c(cccc7c54)-c4ccccc4-6)c3)ccc2-c2ccc(-c3ccc4c5c(cccc35)-c3ccccc3-4)cc21" }
6-(7-fluoranthen-3-yl-9,9-dimethylfluoren-2-yl)hexacyclo[11.10.1.02,11.03,8.014,19.020,24]tetracosa-1,3(8),4,6,9,11,13(24),14,16,18,20,22-dodecaene
[ { "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": "6-(7-fluoranthen-3-yl-9,9-dimethylfluoren-2-yl)hexacyclo[11.10.1.02,11.03,8.014,19.020,24]tetracosa-1,3(8),4,6,9,11,13(24),14,16,18,20,22-dodecaene", "role": "assistant" } ]
297,231
{ "selfies": "[O][=C][Branch1][S][C][C][Branch1][Ring2][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][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)c1ccccc1)C1SCCN1S(=O)(=O)c1ccc(-c2ccccc2)cc1" }
(3R)-5-hydroxy-3-phenyl-1-[(2R)-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": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "(3R)-5-hydroxy-3-phenyl-1-[(2R)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidin-2-yl]pentan-1-one", "role": "assistant" } ]
297,233
{ "selfies": "[C][C][=C][C][=C][Branch2][Ring1][=C][N][Branch1][C][C][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch1][N][=C][Ring2][Ring1][#Branch1]", "smiles": "Cc1ccc(N(C)C(=O)COc2cccc3c2OC(C)(C)C3)nc1" }
2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-methyl-N-(5-methylpyridin-2-yl)acetamide
[ { "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": "2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-methyl-N-(5-methylpyridin-2-yl)acetamide", "role": "assistant" } ]
297,237
{ "selfies": "[C][C][=Branch1][C][=N][O][C][O][C][Branch1][Branch1][C][N][=N+1][=N-1][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][C][Ring1][=N][N][=N+1][=N-1]", "smiles": "CC(=N)OC1OC(CN=[N+]=[N-])C(F)(F)C(F)C1N=[N+]=[N-]" }
[3-azido-6-(azidomethyl)-4,5,5-trifluorooxan-2-yl] ethanimidate
[ { "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": "[3-azido-6-(azidomethyl)-4,5,5-trifluorooxan-2-yl] ethanimidate", "role": "assistant" } ]
297,238
{ "selfies": "[C][O][C][=C][C][=C][Branch2][Ring1][P][C][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][Branch1][#Branch2][C][O][C][=Branch1][C][=O][C][Ring1][=Branch1][C][Ring1][=Branch2][C][C][Ring1][P][C][=C][Ring2][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F]", "smiles": "COc1ccc(C2CCN(C(=O)C3CC4(COC(=O)C4)C3)CC2)cc1C(F)(F)F" }
2-[4-[4-methoxy-3-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-6-oxaspiro[3.4]octan-7-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 for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "2-[4-[4-methoxy-3-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-6-oxaspiro[3.4]octan-7-one", "role": "assistant" } ]
297,240
{ "selfies": "[C][C][=C][C][=N][C][=C][Ring1][=Branch1][N][=C][N][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]", "smiles": "Cc1ccnc2c1ncn2C(=O)NCCc1ccccc1" }
7-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-3-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": "7-methyl-N-(2-phenylethyl)imidazo[4,5-b]pyridine-3-carboxamide", "role": "assistant" } ]
297,242
{ "selfies": "[C][C][=C][C][Branch2][Branch1][Branch2][C][Branch1][C][C][O][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Branch1][#Branch2][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C][N][Ring1][P][C][=Branch1][C][=O][O][C][O][C][=Branch1][C][=O][C][Branch1][C][N][C][C][C][C][N][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring2][Ring2][=N]", "smiles": "Cc1cc(C(C)OCC2(c3ccccc3)CCC3(CCC(=O)N3)CN2C(=O)OCOC(=O)C(N)CCCCN)cc(C(F)(F)F)c1" }
2,6-diaminohexanoyloxymethyl (5S,8S)-8-[[(1R)-1-[3-methyl-5-(trifluoromethyl)phenyl]ethoxy]methyl]-2-oxo-8-phenyl-1,9-diazaspiro[4.5]decane-9-carboxylate
[ { "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": "2,6-diaminohexanoyloxymethyl (5S,8S)-8-[[(1R)-1-[3-methyl-5-(trifluoromethyl)phenyl]ethoxy]methyl]-2-oxo-8-phenyl-1,9-diazaspiro[4.5]decane-9-carboxylate", "role": "assistant" } ]
297,245
{ "selfies": "[C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][N][Branch2][Ring2][#C][C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][O][C][Branch2][Ring1][#Branch2][C][Branch1][#Branch1][O][C][Branch1][C][C][=O][C][Branch1][Branch2][C][O][C][Branch1][C][C][=O][O][C][Branch1][C][C][=O][C][Ring2][Ring1][=Branch2][C][N][=N][Ring2][Ring1][#C]", "smiles": "CCC(=O)Nc1ccccc1-c1cn(C2C=C(C(=O)OC)OC(C(OC(C)=O)C(COC(C)=O)OC(C)=O)C2C)nn1" }
methyl (2R,3R,4R)-3-methyl-4-[4-[2-(propanoylamino)phenyl]triazol-1-yl]-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate
[ { "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": "methyl (2R,3R,4R)-3-methyl-4-[4-[2-(propanoylamino)phenyl]triazol-1-yl]-2-[(1S,2R)-1,2,3-triacetyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylate", "role": "assistant" } ]
297,249
{ "selfies": "[O][=C][Branch1][S][C][C][C][C][N][C][C][C][Branch1][C][F][C][C][Ring1][#Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][S][C][=N][C][Branch2][Ring1][O][C][=C][Branch1][C][F][C][=C][Branch1][Branch2][C][C][C][C][N][Ring1][Branch1][C][=C][Ring1][N][C][C][C][C][Ring1][=Branch1][=C][N][Ring2][Ring1][Branch1][Ring2][Ring1][=Branch2]", "smiles": "O=C(CCCCN1CCC(F)CC1)c1ccc2c(c1)sc1nc(-c3c(F)cc(C4CCCN4)c4c3CCCC4)cn12" }
5-(4-fluoropiperidin-1-yl)-1-[2-[2-fluoro-4-[(2S)-pyrrolidin-2-yl]-5,6,7,8-tetrahydronaphthalen-1-yl]imidazo[2,1-b][1,3]benzothiazol-6-yl]pentan-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": "5-(4-fluoropiperidin-1-yl)-1-[2-[2-fluoro-4-[(2S)-pyrrolidin-2-yl]-5,6,7,8-tetrahydronaphthalen-1-yl]imidazo[2,1-b][1,3]benzothiazol-6-yl]pentan-1-one", "role": "assistant" } ]
297,253
{ "selfies": "[C][C][=C][C][=C][C][Branch1][C][O][=C][C][=C][Branch1][#Branch1][C][Ring1][#Branch1][=C][Ring1][O][C][Branch1][Ring1][C][Cl][C][N][Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][S][C][C][=Branch1][C][=O][C][C][N][C][C][C][C][C][Ring1][=Branch1][=C][C][=C][Ring1][P][Se][Ring2][Ring1][Ring2]", "smiles": "Cc1ccc2c(O)cc3c(c2c1)C(CCl)CN3C(=O)c1cc2cc(CC(=O)CCN3CCCCC3)ccc2[se]1" }
1-[2-[(1S)-1-(chloromethyl)-5-hydroxy-8-methyl-1,2-dihydrobenzo[e]indole-3-carbonyl]-1-benzoselenophen-5-yl]-4-piperidin-1-ylbutan-2-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": "1-[2-[(1S)-1-(chloromethyl)-5-hydroxy-8-methyl-1,2-dihydrobenzo[e]indole-3-carbonyl]-1-benzoselenophen-5-yl]-4-piperidin-1-ylbutan-2-one", "role": "assistant" } ]
297,254
{ "selfies": "[C][=C][C][C][C][Branch2][=Branch1][P][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Branch1][O][N][C][C][C][C][C][N][Branch2][Ring2][=N][C][C][O][C][C][O][C][C][#C][C][O][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][NH1][C][=C][C][=N][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][=N][Ring2][Ring1][Ring1][C][Ring2][Ring2][Ring2][=C][Ring2][Ring2][N][C][Ring2][Ring2][S][=O][C][=Branch1][C][=O][N][Ring2][Branch1][Branch2]", "smiles": "C=C1CCC(N2C(=O)c3cccc(NCC4CCCN(CCOCCOCC#CCOc5ccc(-c6ccc7c(c6)[nH]c6ccncc67)cn5)C4)c3C2=O)C(=O)N1" }
2-(6-methylidene-2-oxopiperidin-3-yl)-4-[[1-[2-[2-[4-[5-(5H-pyrido[4,3-b]indol-7-yl)pyridin-2-yl]oxybut-2-ynoxy]ethoxy]ethyl]piperidin-3-yl]methylamino]isoindole-1,3-dione
[ { "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": "2-(6-methylidene-2-oxopiperidin-3-yl)-4-[[1-[2-[2-[4-[5-(5H-pyrido[4,3-b]indol-7-yl)pyridin-2-yl]oxybut-2-ynoxy]ethoxy]ethyl]piperidin-3-yl]methylamino]isoindole-1,3-dione", "role": "assistant" } ]
297,259
{ "selfies": "[C-1][#N+1][C][C][=C][C][=C][Branch2][#Branch1][O][N][C][=N][C][Branch1][S][N][C][C][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][NH1][N][=Ring1][Branch2][=C][C][Branch2][Branch1][=N][C][=Branch1][C][=O][C][C][C][=C][N][Branch2][Ring2][N][C][C][O][C][C][C][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][=N][C][C][C][C][=Branch1][C][=C][N][C][Ring1][#Branch1][=O][C][Ring1][=C][=O][N][=N][Ring2][Ring2][C][=N][Ring2][Branch1][Branch1][C][=C][Ring2][Branch1][N]", "smiles": "[C-]#[N+]Cc1ccc(Nc2nc(Nc3cc(C4CC4)[nH]n3)cc(C(=O)CCc3cn(CCOCCCC(=O)COc4cccc5c4C(=O)N(C4CCC(=C)NC4=O)C5=O)nn3)n2)cc1" }
4-[5-[2-[4-[3-[6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-[4-(isocyanomethyl)anilino]pyrimidin-4-yl]-3-oxopropyl]triazol-1-yl]ethoxy]-2-oxopentoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione
[ { "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": "4-[5-[2-[4-[3-[6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-[4-(isocyanomethyl)anilino]pyrimidin-4-yl]-3-oxopropyl]triazol-1-yl]ethoxy]-2-oxopentoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione", "role": "assistant" } ]
297,261
{ "selfies": "[C][C][=C][C][=C][C][Branch2][Ring2][P][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring1][#C][C][Branch1][C][C][C][C][=Branch1][C][=N][N][Branch1][N][C][C][C][O][C][Branch1][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][C][Ring1][S][=C][Ring2][Ring1][=Branch1][Cl][=C][Ring2][Ring1][S]", "smiles": "Cc1cccc(C(=O)Nc2cccc(C3(C)CC(=N)N(C4CCOC(C)C4)C(=O)C3)c2Cl)c1" }
N-[2-chloro-3-[(4S)-2-imino-4-methyl-1-[(2R,4R)-2-methyloxan-4-yl]-6-oxopiperidin-4-yl]phenyl]-3-methylbenzamide
[ { "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": "N-[2-chloro-3-[(4S)-2-imino-4-methyl-1-[(2R,4R)-2-methyloxan-4-yl]-6-oxopiperidin-4-yl]phenyl]-3-methylbenzamide", "role": "assistant" } ]
297,263
{ "selfies": "[C][C][C][C][C][C][Branch1][C][C][N][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][C][C][C][=C][C][=C][C][Branch1][C][N][=N][C][=C][C][Ring1][#Branch1][=C][Ring1][O]", "smiles": "CC1CCCC(C)N1CC(=O)NC(C)(C)C(=O)CCc1ccc2c(N)nccc2c1" }
N-[5-(1-aminoisoquinolin-6-yl)-2-methyl-3-oxopentan-2-yl]-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]acetamide
[ { "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": "N-[5-(1-aminoisoquinolin-6-yl)-2-methyl-3-oxopentan-2-yl]-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]acetamide", "role": "assistant" } ]
297,266
{ "selfies": "[C][O][C][=N][C][Branch2][Branch1][Ring1][C][=C][C][=C][C][Branch2][Ring2][=Branch1][C][=C][C][=C][C][Branch2][Ring1][=Branch2][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][C][=Branch1][Ring2][=N][Ring1][#Branch1][C][N][C][C][Ring1][#Branch1][=C][Ring2][Ring1][Ring2][Cl][=C][Ring2][Ring1][O][Cl][=C][N][=C][Ring2][Ring2][C][C][N][C][C][Branch1][C][O][C][Ring1][Branch1]", "smiles": "COc1nc(-c2cccc(-c3cccc(CC(=O)c4cc(C)c5c(n4)CNCC5)c3Cl)c2Cl)cnc1CN1CC(O)C1" }
2-[2-chloro-3-[2-chloro-3-[5-[(3-hydroxyazetidin-1-yl)methyl]-6-methoxypyrazin-2-yl]phenyl]phenyl]-1-(4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridin-2-yl)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-[2-chloro-3-[2-chloro-3-[5-[(3-hydroxyazetidin-1-yl)methyl]-6-methoxypyrazin-2-yl]phenyl]phenyl]-1-(4-methyl-5,6,7,8-tetrahydro-1,7-naphthyridin-2-yl)ethanone", "role": "assistant" } ]
297,269
{ "selfies": "[C][C][=C][C][Branch1][P][C][=C][N][=C][C][=C][Branch1][C][F][C][=C][N][Ring1][#Branch2][Ring1][#Branch1][=N][C][=N][Ring1][S]", "smiles": "Cc1cc(-c2cnc3cc(F)ccn23)ncn1" }
7-fluoro-3-(6-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine
[ { "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": "7-fluoro-3-(6-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine", "role": "assistant" } ]
297,270
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][C][C][C][C][=N][C][=C][Branch1][Branch2][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][=C][Branch2][Ring2][Ring2][C][=Branch1][C][=O][C][C][Branch1][#Branch1][C][C][N][C][C][O][C][=C][C][=C][Branch1][N][C][C][=C][C][=Branch1][C][=O][NH1][C][=Ring1][#Branch1][C][=C][Ring1][=N][C][Ring2][Ring1][#C]", "smiles": "CC(C)(C)C1CCc2nc3c(cc2C1)C=C(C(=O)CC(CCNCCO)c1ccc(-c2ccc(=O)[nH]c2)cc1)C3" }
5-[4-[(3S)-1-[(7S)-7-tert-butyl-5,6,7,8-tetrahydro-3H-cyclopenta[b]quinolin-2-yl]-5-(2-hydroxyethylamino)-1-oxopentan-3-yl]phenyl]-1H-pyridin-2-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": "5-[4-[(3S)-1-[(7S)-7-tert-butyl-5,6,7,8-tetrahydro-3H-cyclopenta[b]quinolin-2-yl]-5-(2-hydroxyethylamino)-1-oxopentan-3-yl]phenyl]-1H-pyridin-2-one", "role": "assistant" } ]
297,271
{ "selfies": "[C][C][Branch1][C][O][Branch2][Ring2][=N][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch1][O][C][C][C][Ring1][Ring1][C][Branch2][Ring1][Ring1][C][=C][N][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][=C][Ring1][#Branch2][=C][Ring2][Ring1][Ring2][C][=C][C][=C][Branch2][Ring1][C][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=N][Ring1][=N][O][C][C][Ring1][=C][Branch1][C][C][C][Branch1][C][N][=O]", "smiles": "CC(O)(CNC(=O)c1ccc(OC2CC2)c(-c2cnc(C(F)(F)F)nc2)c1)c1cc2c(c(-c3ccc(F)cc3)n1)OCC2(C)C(N)=O" }
(3R)-5-[(2S)-1-[[4-cyclopropyloxy-3-[2-(trifluoromethyl)pyrimidin-5-yl]benzoyl]amino]-2-hydroxypropan-2-yl]-7-(4-fluorophenyl)-3-methyl-2H-furo[2,3-c]pyridine-3-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": "(3R)-5-[(2S)-1-[[4-cyclopropyloxy-3-[2-(trifluoromethyl)pyrimidin-5-yl]benzoyl]amino]-2-hydroxypropan-2-yl]-7-(4-fluorophenyl)-3-methyl-2H-furo[2,3-c]pyridine-3-carboxamide", "role": "assistant" } ]
297,272
{ "selfies": "[C][C][Branch1][C][C][O][C][C][C][N][Branch1][#Branch2][C][C][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][=N]", "smiles": "CC(C)OC1CCN(CC2CCCCC2)CC1" }
1-(cyclohexylmethyl)-4-propan-2-yloxypiperidine
[ { "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-(cyclohexylmethyl)-4-propan-2-yloxypiperidine", "role": "assistant" } ]
297,273
{ "selfies": "[C][C][C][C][N][Branch2][Ring2][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][S][C][=N][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][C][=Ring1][#Branch2][N][C][Ring2][Ring1][Branch1][C][C][N][Ring2][Ring1][=C]", "smiles": "CCC1CN(c2ccc3c(c2)CCC(NC(=O)c2sc4nc(C)ccc4c2N)C3)CCN1" }
3-amino-N-[(2R)-6-[(3S)-3-ethylpiperazin-1-yl]-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-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": "3-amino-N-[(2R)-6-[(3S)-3-ethylpiperazin-1-yl]-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide", "role": "assistant" } ]
297,279
{ "selfies": "[N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Branch1][Ring1][O][C][C][Branch1][C][O][C][C][C][C][O][C][Branch2][Ring1][S][C][C][N][Branch2][Ring1][Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][N][=C][C][=C][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2][C][C][Ring2][Ring1][C][C][Ring2][Ring1][=Branch1][=C][Ring2][Ring2][C]", "smiles": "NS(=O)(=O)c1cccc(OCC(O)CCC2COC3(CCN(S(=O)(=O)c4cnc5cc[nH]c5c4)CC3)C2)c1" }
3-[(2S)-2-hydroxy-4-[(3R)-8-(1H-pyrrolo[3,2-b]pyridin-6-ylsulfonyl)-1-oxa-8-azaspiro[4.5]decan-3-yl]butoxy]benzenesulfonamide
[ { "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-[(2S)-2-hydroxy-4-[(3R)-8-(1H-pyrrolo[3,2-b]pyridin-6-ylsulfonyl)-1-oxa-8-azaspiro[4.5]decan-3-yl]butoxy]benzenesulfonamide", "role": "assistant" } ]
297,280
{ "selfies": "[C][C][=C][C][=C][C][Branch2][Branch1][=Branch1][C][=C][N][=C][Branch2][Ring2][O][C][C][C][C][Ring1][Ring1][C][=C][C][Branch2][Ring1][Ring1][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][N][C][=N][N][=N][Ring1][Branch1][=C][C][=Branch1][C][=O][N][Ring2][Ring1][Ring1][Ring2][Ring1][#Branch1][C][Ring2][Ring1][N][=C][C][=C][Ring2][Ring2][C][C][C][Ring2][Ring2][=Branch1][=O]", "smiles": "CC1=Cc2cc(C3=CN=C(C4C5CC5c5cc(-c6cc(Cl)ccc6-n6cnnn6)cc(=O)n54)C3)ccc2CC1=O" }
6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[4-(7-methyl-6-oxo-5H-naphthalen-2-yl)-3H-pyrrol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-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": "6-[5-chloro-2-(tetrazol-1-yl)phenyl]-2-[4-(7-methyl-6-oxo-5H-naphthalen-2-yl)-3H-pyrrol-2-yl]-1,1a,2,7b-tetrahydrocyclopropa[a]indolizin-4-one", "role": "assistant" } ]
297,281
{ "selfies": "[C][C][C][C][Branch1][=N][C][C][C][Branch1][C][C][Branch1][Ring1][C][C][C][C][C][Branch1][C][C][Branch1][Ring1][C][C][C][C]", "smiles": "CCCC(CCC(C)(CC)CC)C(C)(CC)CC" }
3,7-diethyl-3,7-dimethyl-4-propylnonane
[ { "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": "3,7-diethyl-3,7-dimethyl-4-propylnonane", "role": "assistant" } ]
297,284
{ "selfies": "[C][N][Branch1][C][C][C][Branch2][Ring2][=N][C][N][C][=Branch1][C][=O][C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][=C][Ring1][#Branch2][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][F][F][C][C][Ring1][#Branch1][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]", "smiles": "CN(C)C(CNC(=O)CC(c1ccc(C(F)(F)F)nc1)C1(C(C)(F)F)CC1)Cc1ccc(O)cc1" }
3-[1-(1,1-difluoroethyl)cyclopropyl]-N-[(2S)-2-(dimethylamino)-3-(4-hydroxyphenyl)propyl]-3-[6-(trifluoromethyl)pyridin-3-yl]propanamide
[ { "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-[1-(1,1-difluoroethyl)cyclopropyl]-N-[(2S)-2-(dimethylamino)-3-(4-hydroxyphenyl)propyl]-3-[6-(trifluoromethyl)pyridin-3-yl]propanamide", "role": "assistant" } ]
297,285
{ "selfies": "[C][N][C][C][C][Branch2][Ring2][#Branch1][C][N][C][C][=C][C][=N][C][=C][Branch2][Ring1][Ring2][C][=C][C][=C][C][Branch1][#Branch2][O][C][Branch1][C][C][Branch1][C][F][F][=C][Ring1][O][N][Ring1][S][N][=Ring2][Ring1][Ring2][C][C][Ring2][Ring1][N]", "smiles": "CN1CCC(CNc2ccc3ncc(-c4cccc(OC(C)(F)F)c4)n3n2)CC1" }
3-[3-(1,1-difluoroethoxy)phenyl]-N-[(1-methylpiperidin-4-yl)methyl]imidazo[1,2-b]pyridazin-6-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": "3-[3-(1,1-difluoroethoxy)phenyl]-N-[(1-methylpiperidin-4-yl)methyl]imidazo[1,2-b]pyridazin-6-amine", "role": "assistant" } ]
297,286
{ "selfies": "[C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][=C][Branch2][Ring2][C][C][=C][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][=Branch2]", "smiles": "CCC(=O)N(C)c1ccc(-c2ccc(C(=O)CCc3ccc(Cl)nc3)c(OC)c2)cc1" }
N-[4-[4-[3-(6-chloropyridin-3-yl)propanoyl]-3-methoxyphenyl]phenyl]-N-methylpropanamide
[ { "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-[4-[4-[3-(6-chloropyridin-3-yl)propanoyl]-3-methoxyphenyl]phenyl]-N-methylpropanamide", "role": "assistant" } ]
297,287
{ "selfies": "[C][C][C][=Branch1][C][=O][C][C][N][C][C][O][C][C][O][C][C][Branch1][#C][C][O][C][C][O][C][C][N][C][=Branch1][C][=O][C][C][Branch1][#C][C][O][C][C][O][C][C][N][C][=Branch1][C][=O][C][C][C][O][C][C][O][C][C][N][C][=Branch1][C][=O][C][C]", "smiles": "CCC(=O)CCNCCOCCOCC(COCCOCCNC(=O)CC)(COCCOCCNC(=O)CC)COCCOCCNC(=O)CC" }
N-[2-[2-[2-[2-[2-(3-oxopentylamino)ethoxy]ethoxymethyl]-3-[2-[2-(propanoylamino)ethoxy]ethoxy]-2-[2-[2-(propanoylamino)ethoxy]ethoxymethyl]propoxy]ethoxy]ethyl]propanamide
[ { "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-[2-[2-[2-[2-(3-oxopentylamino)ethoxy]ethoxymethyl]-3-[2-[2-(propanoylamino)ethoxy]ethoxy]-2-[2-[2-(propanoylamino)ethoxy]ethoxymethyl]propoxy]ethoxy]ethyl]propanamide", "role": "assistant" } ]
297,288
{ "selfies": "[SeH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][Branch2][Branch1][N][C][=C][C][=C][C][=C][C][Branch2][Ring2][=Branch2][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][N][=N][Ring2][Ring1][Branch2][=C][C][=C][Ring2][Ring2][C][Ring2][Ring1][=C][=C][Ring2][Ring2][Branch2]", "smiles": "[SeH]c1ccccc1-c1cccc(-c2cccc3cc(-c4nc(-c5ccccc5)nc(-c5cccc(-c6ccccc6)c5)n4)ccc23)c1" }
2-[3-[6-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]phenyl]benzeneselenol
[ { "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-[3-[6-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]phenyl]benzeneselenol", "role": "assistant" } ]
297,290
{ "selfies": "[C][C][Branch1][C][C][C][C][=N][N][C][=C][C][Branch2][Ring2][#Branch1][C][=C][C][=N][C][Branch2][Ring1][O][C][C][=C][C][=C][Branch1][S][N][C][C][C][Branch1][=Branch1][N][Branch1][C][C][C][C][Ring1][Branch2][=O][C][=C][Ring1][#C][=N][Ring2][Ring1][=Branch1][=C][C][=Ring2][Ring1][#C][Ring2][Ring1][N]", "smiles": "CC(C)c1cnn2ccc(-c3ccnc(Cc4ccc(N5CCC(N(C)C)C5=O)cc4)n3)cc12" }
3-(dimethylamino)-1-[4-[[4-(3-propan-2-ylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]methyl]phenyl]pyrrolidin-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": "3-(dimethylamino)-1-[4-[[4-(3-propan-2-ylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]methyl]phenyl]pyrrolidin-2-one", "role": "assistant" } ]
297,292
{ "selfies": "[C][C][Branch1][C][N][=N][C][Branch1][C][N][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][F]", "smiles": "CC(N)=NC(N)=Nc1ccccc1F" }
N'-[N'-(2-fluorophenyl)carbamimidoyl]ethanimidamide
[ { "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": "N'-[N'-(2-fluorophenyl)carbamimidoyl]ethanimidamide", "role": "assistant" } ]
297,300
{ "selfies": "[F][C][Branch1][C][F][Branch1][C][F][C][=N][C][=C][C][=C][Ring1][=Branch1][S][C][=C][N][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][N][=C][Branch1][#C][N][C][=C][C][=C][NH1][N][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][C][Ring1][S]", "smiles": "FC(F)(F)c1ncccc1Sc1cnc2c(n1)N=C(Nc1ccc3[nH]ncc3c1)C2" }
N-(1H-indazol-5-yl)-3-[2-(trifluoromethyl)pyridin-3-yl]sulfanyl-7H-pyrrolo[2,3-b]pyrazin-6-amine
[ { "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": "N-(1H-indazol-5-yl)-3-[2-(trifluoromethyl)pyridin-3-yl]sulfanyl-7H-pyrrolo[2,3-b]pyrazin-6-amine", "role": "assistant" } ]
297,302
{ "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][C][C][C]", "smiles": "C=C(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC(=O)NCCCCC" }
[3-hydroxy-2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylphenyl] N-pentylcarbamate
[ { "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-hydroxy-2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylphenyl] N-pentylcarbamate", "role": "assistant" } ]
297,316
{ "selfies": "[C][C][C][C][C][C][C][C][C][Branch2][Ring1][=C][C][C][C][=C][Branch2][Ring1][Ring1][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][=Branch2][C][C][C][Ring1][S][C][C][Ring2][Ring1][=Branch1]", "smiles": "CCCCCC1CCC(C2CC=C(c3cc(F)c(F)c(F)c3C)CC2)CC1" }
1,2,3-trifluoro-4-methyl-5-[4-(4-pentylcyclohexyl)cyclohexen-1-yl]benzene
[ { "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": "1,2,3-trifluoro-4-methyl-5-[4-(4-pentylcyclohexyl)cyclohexen-1-yl]benzene", "role": "assistant" } ]
297,318
{ "selfies": "[C][C][C][=Branch1][C][=O][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Branch2][=Branch1][=Branch2][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][N][Branch2][Ring1][=N][C][C][=Branch1][C][=O][C][C][C][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch1][C][O][C][Ring1][#Branch2][O][C][C][=Branch1][C][=O][N][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][C][C][C][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch1][C][O][C][Ring1][#Branch2][O]", "smiles": "CCC(=O)CCCCC(=O)NCCCCC(NC(=O)CNC(=O)CN(CC(=O)CCCOC1OC(CO)C(O)C(O)C1O)CC(=O)NCCOC1OC(CO)C(O)C(O)C1O)C(=O)CCCOC1OC(CO)C(O)C(O)C1O" }
6-oxo-N-[(5S)-6-oxo-5-[[2-[[2-[[2-oxo-2-[2-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethylamino]ethyl]-[2-oxo-5-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentyl]amino]acetyl]amino]acetyl]amino]-9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl]octanamide
[ { "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-oxo-N-[(5S)-6-oxo-5-[[2-[[2-[[2-oxo-2-[2-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethylamino]ethyl]-[2-oxo-5-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentyl]amino]acetyl]amino]acetyl]amino]-9-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonyl]octanamide", "role": "assistant" } ]
297,322
{ "selfies": "[C][=N][C][=C][C][C][C][N][N][=C][C][=Branch1][=Branch1][=C][Ring1][Branch1][Ring1][#Branch2][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][C][Ring1][#Branch2]", "smiles": "C=NC1=CCCCn2nc3c(c21)CN(C(C)=O)CC3" }
1-[14-(methylideneamino)-4,8,9-triazatricyclo[7.5.0.02,7]tetradeca-1,7,13-trien-4-yl]ethanone
[ { "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": "1-[14-(methylideneamino)-4,8,9-triazatricyclo[7.5.0.02,7]tetradeca-1,7,13-trien-4-yl]ethanone", "role": "assistant" } ]
297,323
{ "selfies": "[C-1][#N+1][C][Branch1][C][C][Branch1][C][C][C][=C][C][Branch2][Ring2][#Branch2][N][C][=N][C][=N][C][=C][Branch2][Ring1][C][O][C][=C][C][=N][C][Branch1][#Branch1][C][C][Branch1][C][C][=O][=C][Ring1][#Branch2][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][Ring1][N][Ring2][Ring1][=Branch1][C][=N][N][Ring2][Ring1][=N][C][C][C][O][C][Ring1][Branch1]", "smiles": "[C-]#[N+]C(C)(C)c1cc(Nc2nc3ncc(Oc4ccnc(CC(C)=O)c4)c(OC)c3n2C)nn1C1CCOC1" }
1-[4-[2-[[5-(2-isocyanopropan-2-yl)-1-[(3S)-oxolan-3-yl]pyrazol-3-yl]amino]-7-methoxy-1-methylimidazo[4,5-b]pyridin-6-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": "What is the IUPAC name of the molecule <molecule_2d> ?", "role": "user" }, { "content": "1-[4-[2-[[5-(2-isocyanopropan-2-yl)-1-[(3S)-oxolan-3-yl]pyrazol-3-yl]amino]-7-methoxy-1-methylimidazo[4,5-b]pyridin-6-yl]oxypyridin-2-yl]propan-2-one", "role": "assistant" } ]
297,326
{ "selfies": "[C][=S][=Branch1][C][=O][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=C][C][=C][N][=C][Branch1][#Branch2][N][C][C][C][C][N][C][Ring1][=Branch1][N][=C][C][Ring1][=N][=C][Ring1][P][C][Branch1][C][F][=C][Ring2][Ring1][Branch2][F]", "smiles": "C=S(=O)(Cc1ccccc1)Nc1ccc(-c2ccc3nc(NC4CCCNC4)ncc3c2)c(F)c1F" }
6-[4-[(benzyl-methylidene-oxo-lambda6-sulfanyl)amino]-2,3-difluorophenyl]-N-[(3S)-piperidin-3-yl]quinazolin-2-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": "6-[4-[(benzyl-methylidene-oxo-lambda6-sulfanyl)amino]-2,3-difluorophenyl]-N-[(3S)-piperidin-3-yl]quinazolin-2-amine", "role": "assistant" } ]
297,331
{ "selfies": "[C][C][Branch1][C][C][C][=N][C][C][=C][Ring1][Branch1][C][=N][C][Branch2][Ring1][#Branch1][N][C][=C][C][=C][Branch1][=Branch2][N][C][C][N][C][C][Ring1][=Branch1][C][Branch1][C][F][=C][Ring1][=N][=N][C][=C][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][Branch2]", "smiles": "CC(C)C1=NCC2=C1c1nc(Nc3ccc(N4CCNCC4)c(F)c3)ncc1CC2" }
N-(3-fluoro-4-piperazin-1-ylphenyl)-9-propan-2-yl-6,7-dihydro-5H-pyrrolo[3,4-h]quinazolin-2-amine
[ { "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-(3-fluoro-4-piperazin-1-ylphenyl)-9-propan-2-yl-6,7-dihydro-5H-pyrrolo[3,4-h]quinazolin-2-amine", "role": "assistant" } ]
297,334
{ "selfies": "[C][C][C][O][C][=C][Branch1][C][Cl][C][=C][Branch2][Ring2][O][C][=C][S][C][=C][C][Branch2][Ring1][=Branch2][O][C][C][C][C][Branch1][#Branch2][C][S][Branch1][C][C][=Branch1][C][=O][=O][Branch1][Ring2][C][Ring1][=Branch2][C][Ring1][#Branch2][=C][C][=C][Ring2][Ring1][Branch1][Ring2][Ring1][C][C][=C][Ring2][Ring1][N][C][#N]", "smiles": "CCCOc1c(Cl)cc(-c2csc3cc(OCC45CC(CS(C)(=O)=O)(C4)C5)ccc23)cc1C#N" }
3-chloro-5-[6-[[3-(methylsulfonylmethyl)-1-bicyclo[1.1.1]pentanyl]methoxy]-1-benzothiophen-3-yl]-2-propoxybenzonitrile
[ { "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": "3-chloro-5-[6-[[3-(methylsulfonylmethyl)-1-bicyclo[1.1.1]pentanyl]methoxy]-1-benzothiophen-3-yl]-2-propoxybenzonitrile", "role": "assistant" } ]
297,336
{ "selfies": "[C][C][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][P][C][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][Branch1][#Branch2][C][O][C][=Branch1][C][=O][C][Ring1][=Branch1][C][Ring1][=Branch2][C][C][Ring1][P][C][=C][Ring2][Ring1][#Branch1]", "smiles": "CC(C)c1ccc(C2CCN(C(=O)C3CC4(COC(=O)C4)C3)CC2)cc1" }
2-[4-(4-propan-2-ylphenyl)piperidine-1-carbonyl]-6-oxaspiro[3.4]octan-7-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": "2-[4-(4-propan-2-ylphenyl)piperidine-1-carbonyl]-6-oxaspiro[3.4]octan-7-one", "role": "assistant" } ]
297,339
{ "selfies": "[C][C][C][=Branch1][C][=O][C][C][=C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][=C][Ring1][N][=N][Ring2][Ring1][#Branch2]", "smiles": "CCC(=O)Cc1cn(-c2ccccc2)c(NC(=O)c2cccc(-c3cnn(C)c3)c2)n1" }
3-(1-methylpyrazol-4-yl)-N-[4-(2-oxobutyl)-1-phenylimidazol-2-yl]benzamide
[ { "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": "3-(1-methylpyrazol-4-yl)-N-[4-(2-oxobutyl)-1-phenylimidazol-2-yl]benzamide", "role": "assistant" } ]
297,341
{ "selfies": "[N][C][=N][C][=C][Branch2][Ring1][=C][C][=C][C][=C][Branch2][Ring1][C][C][C][N][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring1][N][=C][Ring2][Ring1][=Branch2][C][=Branch1][C][=O][C][C][=C][N][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1]", "smiles": "Nc1ncc(-c2ccc(CCNC(=O)OCc3ccccc3)cc2)nc1C(=O)Cc1cnccc1-c1ccccc1" }
benzyl N-[2-[4-[5-amino-6-[2-(4-phenylpyridin-3-yl)acetyl]pyrazin-2-yl]phenyl]ethyl]carbamate
[ { "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": "benzyl N-[2-[4-[5-amino-6-[2-(4-phenylpyridin-3-yl)acetyl]pyrazin-2-yl]phenyl]ethyl]carbamate", "role": "assistant" } ]
297,344
{ "selfies": "[C][C][=N][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][F][C][Branch2][Ring1][#C][C][C][=C][C][=C][Branch1][=C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][C][C][C][NH1][N][=C][Ring1][=C][C][=Ring2][Ring1][C][F][=C][Ring2][Ring1][#Branch2][F]", "smiles": "Cc1ncc(F)cc1S(=O)(=O)Cc1ccc(F)c(-c2ccc3c(C(=O)NCCCN(C)C)[nH]nc3c2F)c1F" }
6-[2,6-difluoro-3-[(5-fluoro-2-methylpyridin-3-yl)sulfonylmethyl]phenyl]-N-[3-(dimethylamino)propyl]-7-fluoro-2H-indazole-3-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": "6-[2,6-difluoro-3-[(5-fluoro-2-methylpyridin-3-yl)sulfonylmethyl]phenyl]-N-[3-(dimethylamino)propyl]-7-fluoro-2H-indazole-3-carboxamide", "role": "assistant" } ]
297,353
{ "selfies": "[C][C][C][C][=C][Branch2][Ring1][#Branch1][S][C][Branch1][O][C][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][=C][Ring1][O][C][=Branch1][C][=O][O][C][Branch1][C][C][C][Ring2][Ring1][Ring1]", "smiles": "CC1Cc2c(sc(CC(=O)C3CC3)c2C(=O)O)C(C)C1" }
2-(2-cyclopropyl-2-oxoethyl)-5,7-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
[ { "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": "2-(2-cyclopropyl-2-oxoethyl)-5,7-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid", "role": "assistant" } ]
297,355
{ "selfies": "[C][C][C][=Branch1][C][=O][C][C][C][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][C][C][C][=C][C][Branch1][=N][O][C][=N][C][=C][Branch1][C][C][C][=N][Ring1][#Branch1][=C][C][C][Branch1][=Branch1][C][Branch1][C][C][=O][=C][N][Branch1][#Branch1][C][Ring2][Ring1][Ring2][=Ring1][Branch2][C][C][=Branch1][C][=O][N][Ring2][Ring2][=Branch1][C][Ring2][Ring2][Branch1][C][Ring2][Ring2][=Branch1]", "smiles": "CCC(=O)C1CC23CNC(=O)CC(C)CCCCc4cc(Oc5ncc(C)cn5)cc5c(C(C)=O)cn(c45)CC(=O)N1C2C3" }
(1R,6R,22R,25S)-16-acetyl-6-methyl-13-(5-methylpyrimidin-2-yl)oxy-25-propanoyl-3,18,21-triazapentacyclo[19.2.2.111,15.01,22.018,26]hexacosa-11(26),12,14,16-tetraene-4,20-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": "(1R,6R,22R,25S)-16-acetyl-6-methyl-13-(5-methylpyrimidin-2-yl)oxy-25-propanoyl-3,18,21-triazapentacyclo[19.2.2.111,15.01,22.018,26]hexacosa-11(26),12,14,16-tetraene-4,20-dione", "role": "assistant" } ]
297,357
{ "selfies": "[C][C][C][Branch2][Ring2][=N][N][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][=N][C][=C][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1][C][=C][Ring1][P][C][=C][Ring2][Ring1][#Branch1][C][C][Ring2][Ring1][N]", "smiles": "CCC1(N(C)c2ccc(-c3ccc(C(=O)CCc4ccc(Cl)nc4)cc3)cc2)CC1" }
3-(6-chloropyridin-3-yl)-1-[4-[4-[(1-ethylcyclopropyl)-methylamino]phenyl]phenyl]propan-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": "3-(6-chloropyridin-3-yl)-1-[4-[4-[(1-ethylcyclopropyl)-methylamino]phenyl]phenyl]propan-1-one", "role": "assistant" } ]
297,362
{ "selfies": "[C][=C][C][=C][C][=N][C][=C][C][Branch2][Ring2][=C][O][C][=C][C][=C][Branch2][Ring1][S][C][C][=Branch1][C][=O][C][=C][NH1][C][Branch1][C][C][=C][Branch1][=N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring1][#C][=O][C][=C][Ring2][Ring1][=Branch2][F][=C][Ring2][Ring1][P][N][=C][Ring2][Ring2][Branch1][O][C]", "smiles": "C=Cc1cc2nccc(Oc3ccc(CC(=O)c4c[nH]c(C)c(-c5ccc(F)cc5C)c4=O)cc3F)c2nc1OC" }
5-[2-[4-[(7-ethenyl-6-methoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]acetyl]-3-(4-fluoro-2-methylphenyl)-2-methyl-1H-pyridin-4-one
[ { "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": "5-[2-[4-[(7-ethenyl-6-methoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]acetyl]-3-(4-fluoro-2-methylphenyl)-2-methyl-1H-pyridin-4-one", "role": "assistant" } ]
297,367
{ "selfies": "[C][O][C][=C][C][Branch2][Branch1][=N][N][C][C][C][Branch2][Ring2][P][N][C][C][N][Branch2][Ring2][Branch1][C][=Branch1][C][=O][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][=C][=O][C][C][Ring2][Ring1][N][C][C][Ring2][Ring2][C][=C][C][=C][Ring2][Ring2][Branch2][C][C][=N][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][C]", "smiles": "COc1cc(N2CCC(N3CCN(C(=O)CCc4ccc5c(c4)CN(C4CCC(=O)NC4=O)C5=O)CC3)CC2)ccc1Cc1ncc(Cl)c(Cc2ccccc2P(C)(C)=O)n1" }
3-[6-[3-[4-[1-[4-[[5-chloro-4-[(2-dimethylphosphorylphenyl)methyl]pyrimidin-2-yl]methyl]-3-methoxyphenyl]piperidin-4-yl]piperazin-1-yl]-3-oxopropyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
[ { "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-[6-[3-[4-[1-[4-[[5-chloro-4-[(2-dimethylphosphorylphenyl)methyl]pyrimidin-2-yl]methyl]-3-methoxyphenyl]piperidin-4-yl]piperazin-1-yl]-3-oxopropyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione", "role": "assistant" } ]
297,369
{ "selfies": "[C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][=N][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1][C][C][Ring1][P][C][=C][Ring2][Ring1][#Branch1][F]", "smiles": "CCC(=O)N(C)c1ccc(N2CCN(C(=O)CCc3ccc(Cl)nc3)CC2)cc1F" }
N-[4-[4-[3-(6-chloropyridin-3-yl)propanoyl]piperazin-1-yl]-2-fluorophenyl]-N-methylpropanamide
[ { "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-[4-[4-[3-(6-chloropyridin-3-yl)propanoyl]piperazin-1-yl]-2-fluorophenyl]-N-methylpropanamide", "role": "assistant" } ]
297,370
{ "selfies": "[C][C][Branch1][C][C][C][O][C][=Branch1][C][=O][C][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][C][C][=C][C][=C][C][=C][C][Branch1][#C][C][Ring1][=C][=C][Ring1][=Branch1][C][Ring1][#C][=C][Ring1][#Branch2][Ring1][=N][=C][Branch2][Branch1][#Branch1][C][C][Ring1][=Branch2][=C][C][C][C][=C][Branch2][Ring1][P][C][Ring2][Ring1][Ring2][C][=Branch2][Ring1][=Branch1][=C][C][=Ring2][Ring1][Branch2][C][C][Ring2][Ring1][N][=C][C][Ring2][Ring1][#C][Ring2][Ring2][Ring1][Ring2][Ring2][#Branch2][C][Ring1][O][C][Ring2][Ring1][O][C][Ring2][Ring1][#Branch2][Ring1][#C][C][Ring2][Ring2][=Branch1]", "smiles": "CC(C)COC(=O)CCCC1(c2ccccc2)C2C3=c4c5c6c7c8c9c%10c%11c%12c%13c%14c%15c(c4c%13c5c%118)=C(CC%15=CC4CC5=C(C%10C(=CC=9CC7=CC621)C5)C%12C%144)C3" }
2-methylpropyl 4-(40-phenyl-40-heptadecacyclo[9.7.7.719,25.413,17.321,23.111,12.03,31.05,30.07,28.09,26.015,37.020,36.022,38.024,39.027,33.029,34.032,35]tetraconta-3(31),5,7(28),9,13(39),15(37),17,20(36),21(35),22(38),23(33),24,26,29(34)-tetradecaenyl)butanoate
[ { "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-methylpropyl 4-(40-phenyl-40-heptadecacyclo[9.7.7.719,25.413,17.321,23.111,12.03,31.05,30.07,28.09,26.015,37.020,36.022,38.024,39.027,33.029,34.032,35]tetraconta-3(31),5,7(28),9,13(39),15(37),17,20(36),21(35),22(38),23(33),24,26,29(34)-tetradecaenyl)butanoate", "role": "assistant" } ]
297,372
{ "selfies": "[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=Branch1][C][=O][NH1][C][=C][Branch1][#C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][N][Ring2][Ring1][Branch1][Ring1][S]", "smiles": "Cc1ccccc1-c1cc(=O)[nH]c2c(-c3ccc(Cl)c(Cl)c3)c(C3CC3)nn12" }
2-cyclopropyl-3-(3,4-dichlorophenyl)-7-(2-methylphenyl)-4H-pyrazolo[1,5-a]pyrimidin-5-one
[ { "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": "2-cyclopropyl-3-(3,4-dichlorophenyl)-7-(2-methylphenyl)-4H-pyrazolo[1,5-a]pyrimidin-5-one", "role": "assistant" } ]
297,373
{ "selfies": "[C][O][N][=C][Branch2][Ring2][Ring2][C][=C][C][=C][C][=C][N][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][=C][Ring1][#Branch2][C][Ring1][#C][=N][Ring2][Ring1][Ring1][C][=C][C][=C][S][Ring1][Branch1]", "smiles": "CON=C(c1ccc2ccn(-c3ccc(S(C)(=O)=O)cc3)c2n1)c1cccs1" }
(E)-N-methoxy-1-[1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-yl]-1-thiophen-2-ylmethanimine
[ { "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": "(E)-N-methoxy-1-[1-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridin-6-yl]-1-thiophen-2-ylmethanimine", "role": "assistant" } ]
297,376
{ "selfies": "[C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=C][N][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][Ring1][=N]", "smiles": "Cc1ccc2c(c1)CCC2NC(=O)c1ccc(NS(=O)(=O)N(C)C)cc1" }
4-(dimethylsulfamoylamino)-N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]benzamide
[ { "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-(dimethylsulfamoylamino)-N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]benzamide", "role": "assistant" } ]
297,379
{ "selfies": "[C][C][=Branch1][C][=O][C][O][C][Branch2][=Branch1][Ring1][O][C][C][C][C][Branch1][C][C][C][Branch2][Ring2][=C][C][C][C][Branch1][C][C][C][Ring1][Branch2][C][C][=C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][Branch2][Branch1][=Branch1][C][Branch1][C][C][=O][C][Branch1][C][C][C][C][Ring1][S][Ring2][Ring1][Branch1][C][C][Ring2][Ring1][#C][Branch1][C][C][C][=O][C][Branch1][C][C][C][Branch1][C][C][C][Ring2][Ring2][O][C]", "smiles": "CC(=O)C1OC(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(C)=O)C(C)CC34C)C2(C)C=O)C(C)C(C)C1C" }
(3S,4R,4aR,6aS,6bS,8aS)-8a-acetyl-3-[(2R,4R,5S)-6-acetyl-3,4,5-trimethyloxan-2-yl]oxy-4,6a,6b,8,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carbaldehyde
[ { "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": "(3S,4R,4aR,6aS,6bS,8aS)-8a-acetyl-3-[(2R,4R,5S)-6-acetyl-3,4,5-trimethyloxan-2-yl]oxy-4,6a,6b,8,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carbaldehyde", "role": "assistant" } ]
297,382
{ "selfies": "[C][C][C][=C][Branch1][C][C][C][Branch1][C][C][=C][Branch2][=Branch1][=Branch2][C][N][C][=C][Branch2][Branch1][=N][C][O][C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][#Branch2][C][C][Branch1][C][C][Branch1][C][C][C][=C][C][Branch1][C][C][=C][Branch1][=N][O][C][C][=C][N][Branch1][C][C][N][=N][Ring1][=Branch1][C][=C][Ring1][#C][Ring2][Ring1][Ring2][N][=N][Ring2][Ring2][=Branch1][C][Branch1][C][C][=C][Ring2][Ring2][S][C]", "smiles": "CCc1c(C)c(C)c(Cn2cc(COc3cc4c(cc3C)C(C)(C)CC43CC(C)(C)c4cc(C)c(OCc5cn(C)nn5)cc43)nn2)c(C)c1C" }
1-[(4-ethyl-2,3,5,6-tetramethylphenyl)methyl]-4-[[1',1',3,3,5,6'-hexamethyl-6-[(1-methyltriazol-4-yl)methoxy]-1,3'-spirobi[2H-indene]-5'-yl]oxymethyl]triazole
[ { "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": "1-[(4-ethyl-2,3,5,6-tetramethylphenyl)methyl]-4-[[1',1',3,3,5,6'-hexamethyl-6-[(1-methyltriazol-4-yl)methoxy]-1,3'-spirobi[2H-indene]-5'-yl]oxymethyl]triazole", "role": "assistant" } ]
297,385
{ "selfies": "[C][O][C][=C][C][Branch2][Ring2][N][N][C][=N][C][Branch2][Ring1][P][N][C][=N][C][=C][Branch2][Ring1][Ring1][C][Branch1][=N][N][C][C][C][C][Ring1][Branch1][C][Branch1][C][N][=O][=N][Ring1][=C][C][N][C][C][Ring1][S][=C][Ring2][Ring1][Branch2][=C][C][Branch1][C][C][=C][Ring2][Ring1][#C][C]", "smiles": "COc1cc(-n2cnc(Nc3nc4c(c(N5CCCC5C(N)=O)n3)CNCC4)c2)cc(C)c1C" }
(2S)-1-[2-[[1-(3-methoxy-4,5-dimethylphenyl)imidazol-4-yl]amino]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-yl]pyrrolidine-2-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": "(2S)-1-[2-[[1-(3-methoxy-4,5-dimethylphenyl)imidazol-4-yl]amino]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-yl]pyrrolidine-2-carboxamide", "role": "assistant" } ]
297,387
{ "selfies": "[C][N][C][Branch2][Branch1][S][C][=C][N][Branch1][=N][C][O][C][C][Si][Branch1][C][C][Branch1][C][C][C][C][=N][C][=C][C][Branch2][Ring1][S][O][C][=C][Branch1][C][F][C][=C][Branch1][P][C][C][=Branch1][C][=O][C][C][C][Branch1][C][F][C][O][C][Ring1][Branch1][C][=C][Ring1][P][F][=C][Ring2][Ring2][Ring2][Ring2][Ring1][=Branch2][=C][N][=C][Ring2][Ring2][=Branch2][Cl]", "smiles": "Cn1c(-c2cn(COCC[Si](C)(C)C)c3nccc(Oc4c(F)cc(CC(=O)CCC5(F)COC5)cc4F)c23)cnc1Cl" }
1-[4-[3-(2-chloro-3-methylimidazol-4-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]oxy-3,5-difluorophenyl]-4-(3-fluorooxetan-3-yl)butan-2-one
[ { "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-[4-[3-(2-chloro-3-methylimidazol-4-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]oxy-3,5-difluorophenyl]-4-(3-fluorooxetan-3-yl)butan-2-one", "role": "assistant" } ]
297,391
{ "selfies": "[C][N][C][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][Ring1]", "smiles": "CN1CC(c2cccc(C(F)(F)F)c2)c2ccccc21" }
1-methyl-3-[3-(trifluoromethyl)phenyl]-2,3-dihydroindole
[ { "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-methyl-3-[3-(trifluoromethyl)phenyl]-2,3-dihydroindole", "role": "assistant" } ]
297,392
{ "selfies": "[C][C][N][C][=Branch1][C][=O][C][Branch1][P][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Branch1][C][C][=N][N][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][=Ring1][O][Ring2][Ring1][P]", "smiles": "CCN1C(=O)C(CC(=O)c2cccc(C)c2)C(c2ccc(F)cc2)c2c(C)nn(CC(F)(F)F)c21" }
(4S,5S)-7-ethyl-4-(4-fluorophenyl)-3-methyl-5-[2-(3-methylphenyl)-2-oxoethyl]-1-(2,2,2-trifluoroethyl)-4,5-dihydropyrazolo[3,4-b]pyridin-6-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": "(4S,5S)-7-ethyl-4-(4-fluorophenyl)-3-methyl-5-[2-(3-methylphenyl)-2-oxoethyl]-1-(2,2,2-trifluoroethyl)-4,5-dihydropyrazolo[3,4-b]pyridin-6-one", "role": "assistant" } ]
297,394
{ "selfies": "[C][C][Branch1][C][O][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][S][C][Ring1][Branch1][=C][Ring1][=Branch2][C][=C][C][=C][Branch2][Ring1][C][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=N][Ring1][=N][O][C][C][Ring1][=C][Branch1][C][C][C][Branch1][C][N][=O]", "smiles": "CC(O)(CNC(=O)c1ccc2ncsc2c1)c1cc2c(c(-c3ccc(F)cc3)n1)OCC2(C)C(N)=O" }
(3R)-5-[(2S)-1-(1,3-benzothiazole-6-carbonylamino)-2-hydroxypropan-2-yl]-7-(4-fluorophenyl)-3-methyl-2H-furo[2,3-c]pyridine-3-carboxamide
[ { "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)-5-[(2S)-1-(1,3-benzothiazole-6-carbonylamino)-2-hydroxypropan-2-yl]-7-(4-fluorophenyl)-3-methyl-2H-furo[2,3-c]pyridine-3-carboxamide", "role": "assistant" } ]
297,395
{ "selfies": "[C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][P][Ring1][#Branch1]", "smiles": "Cc1ccc2c(c1)c(=O)n(C(C)(C)C)c1cc(O)ccc21" }
5-tert-butyl-3-hydroxy-8-methylphenanthridin-6-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": "5-tert-butyl-3-hydroxy-8-methylphenanthridin-6-one", "role": "assistant" } ]
297,397
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][C][C][C][N][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][O][Ring2][Ring1][=Branch2]", "smiles": "CC(C)(C)OC(=O)CCC1CN(C(=O)N2CCc3ccccc3C2c2ccc(F)cc2)CCO1" }
tert-butyl 3-[(2R)-4-[(1S)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]morpholin-2-yl]propanoate
[ { "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": "tert-butyl 3-[(2R)-4-[(1S)-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]morpholin-2-yl]propanoate", "role": "assistant" } ]
297,401
{ "selfies": "[C][C][C][C][N][C][=N][C][=C][C][Branch2][=Branch1][=C][C][=C][C][=C][Branch2][=Branch1][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][N][Branch2][Ring2][#C][C][=Branch1][C][=O][N][C][C][O][C][C][C][O][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][=C][=O][C][C][Ring2][Ring2][=Branch1][C][=C][Ring2][Ring2][#C][=N][N][Branch1][N][C][C][C][C][Branch1][C][O][C][C][Ring1][#Branch1][C][Ring2][Branch1][O][=N][Ring2][Branch1][#C]", "smiles": "CCCCNc1ncc2c(-c3ccc(S(=O)(=O)N4CCN(C(=O)NCCOCCCOCCCc5cccc6c5C(=O)N(C5CCC(=O)NC5=O)C6=O)CC4)cc3)nn(C3CCC(O)CC3)c2n1" }
4-[4-[6-(butylamino)-1-(4-hydroxycyclohexyl)pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]sulfonyl-N-[2-[3-[3-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]propoxy]propoxy]ethyl]piperazine-1-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": "4-[4-[6-(butylamino)-1-(4-hydroxycyclohexyl)pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]sulfonyl-N-[2-[3-[3-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]propoxy]propoxy]ethyl]piperazine-1-carboxamide", "role": "assistant" } ]
297,405
{ "selfies": "[C][C][=C][C][=C][C][Branch2][Ring2][#C][C][=N][C][=C][C][Branch2][Ring2][Ring1][N][C][=C][C][=N][C][Branch2][Ring1][=Branch1][C][C][=C][C][=C][Branch1][O][C][N][C][C][C][C][C][C][Ring1][#Branch1][C][=C][Ring1][=C][=N][Ring2][Ring1][Branch1][=N][Ring2][Ring1][N][=N][Ring2][Ring2][C]", "smiles": "Cc1cccc(-c2nccc(Nc3ccnc(Cc4ccc(CN5CCCCCC5)cc4)n3)n2)n1" }
2-[[4-(azepan-1-ylmethyl)phenyl]methyl]-N-[2-(6-methylpyridin-2-yl)pyrimidin-4-yl]pyrimidin-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": "2-[[4-(azepan-1-ylmethyl)phenyl]methyl]-N-[2-(6-methylpyridin-2-yl)pyrimidin-4-yl]pyrimidin-4-amine", "role": "assistant" } ]
297,408
{ "selfies": "[C][C][=C][C][=C][Branch2][Ring2][=Branch1][C][Branch1][C][C][N][C][=Branch1][C][=O][N][C][=Branch1][C][=O][C][Branch1][=N][C][C][=C][C][=N][C][Branch1][C][N][=C][Ring1][#Branch1][C][Ring1][=N][C][=Branch1][C][=O][O][C][=C][Ring2][Ring1][O]", "smiles": "Cc1ccc(C(C)NC(=O)N2C(=O)C(Cc3ccnc(N)c3)C2C(=O)O)cc1" }
(2S,3R)-3-[(2-aminopyridin-4-yl)methyl]-1-[[(1R)-1-(4-methylphenyl)ethyl]carbamoyl]-4-oxoazetidine-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,3R)-3-[(2-aminopyridin-4-yl)methyl]-1-[[(1R)-1-(4-methylphenyl)ethyl]carbamoyl]-4-oxoazetidine-2-carboxylic acid", "role": "assistant" } ]
297,409
{ "selfies": "[C][C][C][=Branch1][C][=O][C][C][C][C][N][C][C][C][C][C][C][C][C][=C][C][Branch1][N][C][=C][N][=C][Branch1][C][C][C][=N][Ring1][#Branch1][=C][C][C][Branch1][=Branch1][C][Branch1][C][C][=O][=N][N][Branch1][#Branch1][C][Ring2][Ring1][Ring1][=Ring1][Branch2][C][C][=Branch1][C][=O][N][Ring2][Ring2][Ring1][C][Ring2][Ring2][C][C][Ring2][Ring2][Ring1]", "smiles": "CCC(=O)C1CC23CNCCCCCCCc4cc(-c5cnc(C)cn5)cc5c(C(C)=O)nn(c45)CC(=O)N1C2C3" }
(1R,22R,25S)-16-acetyl-13-(5-methylpyrazin-2-yl)-25-propanoyl-3,17,18,21-tetrazapentacyclo[19.2.2.111,15.01,22.018,26]hexacosa-11(26),12,14,16-tetraen-20-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": "(1R,22R,25S)-16-acetyl-13-(5-methylpyrazin-2-yl)-25-propanoyl-3,17,18,21-tetrazapentacyclo[19.2.2.111,15.01,22.018,26]hexacosa-11(26),12,14,16-tetraen-20-one", "role": "assistant" } ]
297,411
{ "selfies": "[C][C][C][Branch1][C][C][C][C][P][=Branch1][C][=O][Branch1][C][O][O][C][C][N][C][=Branch1][C][=O][C][=C][C][C][=Branch1][C][=O][N][Branch2][Ring1][Ring1][C][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C][Branch1][C][C][C][O][C][=Branch1][C][=O][C][=Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][#Branch1][C][Ring2][Ring1][O][=O]", "smiles": "CCC(C)CCP(=O)(O)OCCn1c(=O)c2cc3c(=O)n(CCOP(=O)(O)OCC(C)CO)c(=O)c3cc2c1=O" }
2-[2-[2-[hydroxy-(3-hydroxy-2-methylpropoxy)phosphoryl]oxyethyl]-1,3,5,7-tetraoxopyrrolo[3,4-f]isoindol-6-yl]ethoxy-(3-methylpentyl)phosphinic acid
[ { "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-[2-[2-[hydroxy-(3-hydroxy-2-methylpropoxy)phosphoryl]oxyethyl]-1,3,5,7-tetraoxopyrrolo[3,4-f]isoindol-6-yl]ethoxy-(3-methylpentyl)phosphinic acid", "role": "assistant" } ]
297,412
{ "selfies": "[C][=C][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][S][N][C][=C][C][=C][Branch1][C][O][C][Branch1][C][Cl][=C][Ring1][Branch2][N][=C][N][=C][Ring1][#C][C][=C][Ring2][Ring1][Ring1][C][#C][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][Ring1][=Branch1]", "smiles": "C=CC(=O)Cc1cc2c(Nc3ccc(O)c(Cl)c3)ncnc2cc1C#CC1C2CN(C)CC12" }
1-[4-(3-chloro-4-hydroxyanilino)-7-[2-[(1S,5R)-3-methyl-3-azabicyclo[3.1.0]hexan-6-yl]ethynyl]quinazolin-6-yl]but-3-en-2-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": "1-[4-(3-chloro-4-hydroxyanilino)-7-[2-[(1S,5R)-3-methyl-3-azabicyclo[3.1.0]hexan-6-yl]ethynyl]quinazolin-6-yl]but-3-en-2-one", "role": "assistant" } ]
297,413
{ "selfies": "[C][C][=C][C][=C][Branch2][Ring2][#Branch2][O][C][C][=Branch1][C][=O][N][C][C][Branch1][Branch2][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][#Branch2][C][=Branch1][C][=O][N][C][Branch1][Ring1][C][#N][C][C][C][C][C][C][Ring1][Branch1][=O][C][=C][Ring2][Ring1][P]", "smiles": "Cc1ccc(OCC(=O)N2CC3(CCCCC3)CC2C(=O)NC(C#N)CC2CCCC2=O)cc1" }
N-[(1S)-1-cyano-2-[(1S)-2-oxocyclopentyl]ethyl]-2-[2-(4-methylphenoxy)acetyl]-2-azaspiro[4.5]decane-3-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": "N-[(1S)-1-cyano-2-[(1S)-2-oxocyclopentyl]ethyl]-2-[2-(4-methylphenoxy)acetyl]-2-azaspiro[4.5]decane-3-carboxamide", "role": "assistant" } ]
297,415
{ "selfies": "[C][C][=N][C][=C][Branch2][Ring2][Ring1][C][=C][C][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][=C][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=N][Ring2][Ring1][Branch1][C][=N][Ring2][Ring1][O]", "smiles": "Cc1ncc(-c2cc(C(=O)c3ccccc3Cl)cc(N3CCOCC3)n2)cn1" }
(2-chlorophenyl)-[2-(2-methylpyrimidin-5-yl)-6-morpholin-4-ylpyridin-4-yl]methanone
[ { "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": "(2-chlorophenyl)-[2-(2-methylpyrimidin-5-yl)-6-morpholin-4-ylpyridin-4-yl]methanone", "role": "assistant" } ]
297,416
{ "selfies": "[C][C][Branch1][C][C][N][N][=C][Branch2][Ring2][Ring2][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][=Branch1][C][=O][N][C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][O][N][=Ring1][=Branch2][C][=C][Ring2][Ring1][Ring1][C][=C][Branch1][C][N][N][=C][N][=C][Ring1][#Branch1][Ring2][Ring1][=N]", "smiles": "CC(C)n1nc(-c2ccc(CC(=O)Nc3cc(C(C)(C)C)on3)cc2)c2c(N)ncnc21" }
2-[4-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)phenyl]-N-[5-(1,1,1-trideuterio-2-methylpropan-2-yl)-1,2-oxazol-3-yl]acetamide
[ { "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": "2-[4-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)phenyl]-N-[5-(1,1,1-trideuterio-2-methylpropan-2-yl)-1,2-oxazol-3-yl]acetamide", "role": "assistant" } ]
297,420
{ "selfies": "[C][C][C][C][C][N][C][=Branch2][=Branch1][C][=C][C][=C][C][=C][C][=C][C][=N+1][Branch1][N][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=C][C][=C][C][Branch1][C][C][=C][C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][=C][C][Ring1][O][=C][Ring1][#C][C][Ring2][Ring1][=Branch2][Branch1][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][Ring1][C][C][C][=C][Ring2][Ring2][=C][C][=C][C][=C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=C][Branch1][C][C][C][=C][Ring1][#C][Ring1][O]", "smiles": "CCCCCN1C(=CC=CC=CC=CC2=[N+](CCCS(=O)(=O)O)c3ccc4c(C)cc(S(=O)(=O)O)cc4c3C2(C)CS(=O)(=O)O)C(C)(CC)c2c1ccc1c(S(=O)(=O)O)cc(C)cc21" }
2-[7-[1,6-dimethyl-8-sulfo-1-(sulfomethyl)-3-(3-sulfopropyl)benzo[e]indol-3-ium-2-yl]hepta-2,4,6-trienylidene]-1-ethyl-1,8-dimethyl-3-pentylbenzo[e]indole-6-sulfonic 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-[7-[1,6-dimethyl-8-sulfo-1-(sulfomethyl)-3-(3-sulfopropyl)benzo[e]indol-3-ium-2-yl]hepta-2,4,6-trienylidene]-1-ethyl-1,8-dimethyl-3-pentylbenzo[e]indole-6-sulfonic acid", "role": "assistant" } ]
297,421
{ "selfies": "[C][C][C][C][=Branch1][C][=O][C][C][P][=Branch1][C][=O][Branch2][Ring1][Ring2][N][Branch1][=Branch2][C][C][C][=Branch1][C][=O][C][C][C][C][C][=Branch1][C][=O][C][C][N][Branch1][=Branch2][C][C][C][=Branch1][C][=O][C][C][C][C][C][=Branch1][C][=O][C][C]", "smiles": "CCCC(=O)CCP(=O)(N(CCC(=O)CC)CCC(=O)CC)N(CCC(=O)CC)CCC(=O)CC" }
1-bis[bis(3-oxopentyl)amino]phosphorylhexan-3-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-bis[bis(3-oxopentyl)amino]phosphorylhexan-3-one", "role": "assistant" } ]
297,423
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][Branch1][#C][C][=C][C][=C][Branch1][C][I][C][Branch1][C][F][=C][Ring1][Branch2][C][C][Ring1][O]", "smiles": "CC(C)(C)OC(=O)NC1(c2ccc(I)c(F)c2)CC1" }
tert-butyl N-[1-(3-fluoro-4-iodophenyl)cyclopropyl]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": "tert-butyl N-[1-(3-fluoro-4-iodophenyl)cyclopropyl]carbamate", "role": "assistant" } ]
297,424
{ "selfies": "[C][O][C][C][Branch2][Ring1][Ring2][C][Branch1][O][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][=O][O][C][O][C][Branch1][C][C][Branch1][C][C][O][C][Ring1][#Branch1][Ring2][Ring1][#Branch1]", "smiles": "COC1C(C(CSc2ccccc2)OC(C)=O)OC2OC(C)(C)OC21" }
[1-[(3aR,5S,6S,6aS)-6-methoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-phenylsulfanylethyl] 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 for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "[1-[(3aR,5S,6S,6aS)-6-methoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-phenylsulfanylethyl] acetate", "role": "assistant" } ]
297,425
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][C][Branch1][Ring2][C][C][N][=C][Ring1][#Branch2]", "smiles": "CC(C)(C)OC(=O)c1cc(Cl)cc(CCN)c1" }
tert-butyl 3-(2-aminoethyl)-5-chlorobenzoate
[ { "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": "tert-butyl 3-(2-aminoethyl)-5-chlorobenzoate", "role": "assistant" } ]
297,427
{ "selfies": "[O][=C][C][C][C][Branch2][Ring2][#Branch2][N][C][C][=C][C][=C][C][Branch2][Ring1][#Branch1][C][N][C][C][C][C][C][Ring1][=Branch1][C][C][C][C][C][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][=C][Ring2][Ring1][Ring2][C][Ring2][Ring1][#Branch1][=O][C][=Branch1][C][=O][N][Ring2][Ring1][#C]", "smiles": "O=C1CCC(N2Cc3cccc(CN4CCCCC45CC4CCC(C5)N4)c3C2=O)C(=O)N1" }
3-[3-oxo-4-(spiro[8-azabicyclo[3.2.1]octane-3,2'-piperidine]-1'-ylmethyl)-1H-isoindol-2-yl]piperidine-2,6-dione
[ { "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-[3-oxo-4-(spiro[8-azabicyclo[3.2.1]octane-3,2'-piperidine]-1'-ylmethyl)-1H-isoindol-2-yl]piperidine-2,6-dione", "role": "assistant" } ]
297,428
{ "selfies": "[C][C][Branch1][S][C][C][C][C][C][C][C][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][=C][=O]", "smiles": "CC(CC1CC2CCC(C1)N2)NCc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O" }
4-[[1-(8-azabicyclo[3.2.1]octan-3-yl)propan-2-ylamino]methyl]-2-(2,6-dioxopiperidin-3-yl)isoindole-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 for the molecule whose SMILES representation is <molecule_2d> ?", "role": "user" }, { "content": "4-[[1-(8-azabicyclo[3.2.1]octan-3-yl)propan-2-ylamino]methyl]-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione", "role": "assistant" } ]
297,429
{ "selfies": "[C][=C][C][O][C][=Branch1][C][=O][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Branch1][Ring1][O][C][C][Branch1][C][F][Branch1][C][F][F]", "smiles": "C=CCOC(=O)NC(C(=O)O)C(OC)C(F)(F)F" }
4,4,4-trifluoro-3-methoxy-2-(prop-2-enoxycarbonylamino)butanoic 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": "4,4,4-trifluoro-3-methoxy-2-(prop-2-enoxycarbonylamino)butanoic acid", "role": "assistant" } ]
297,430
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][Si][Branch1][C][C][Branch1][C][C][O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2][N]", "smiles": "CC(C)(C)[Si](C)(C)Oc1cc2ccccc2cc1N" }
3-[tert-butyl(dimethyl)silyl]oxynaphthalen-2-amine
[ { "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-[tert-butyl(dimethyl)silyl]oxynaphthalen-2-amine", "role": "assistant" } ]
297,431
{ "selfies": "[N][C][Branch2][Ring2][N][C][C][C][C][C][C][N][Ring1][=Branch1][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][#C][=O][C][Branch1][C][F][Branch1][C][F][F]", "smiles": "NC(CC1CCCCN1Cc1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O)C(F)(F)F" }
5-[[2-(2-amino-3,3,3-trifluoropropyl)piperidin-1-yl]methyl]-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione
[ { "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-[[2-(2-amino-3,3,3-trifluoropropyl)piperidin-1-yl]methyl]-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione", "role": "assistant" } ]
297,432
{ "selfies": "[C][C][Branch1][C][C][C][N][Branch2][Ring1][P][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][=C][=O][C][C][Ring2][Ring1][#Branch2][C][N]", "smiles": "CC1(C)CN(Cc2cccc3c2C(=O)N(C2CCC(=O)NC2=O)C3=O)CC1CN" }
4-[[4-(aminomethyl)-3,3-dimethylpyrrolidin-1-yl]methyl]-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione
[ { "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-[[4-(aminomethyl)-3,3-dimethylpyrrolidin-1-yl]methyl]-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione", "role": "assistant" } ]
297,433
{ "selfies": "[C][#C][C][N][N][=C][Branch1][Ring1][C][=O][C][=C][Branch1][Ring1][C][#N][C][=C][C][=C][Ring1][Branch2][Ring1][=N]", "smiles": "C#CCn1nc(C=O)c2c(C#N)cccc21" }
3-formyl-1-prop-2-ynylindazole-4-carbonitrile
[ { "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-formyl-1-prop-2-ynylindazole-4-carbonitrile", "role": "assistant" } ]
297,434
{ "selfies": "[C][N][C][C][N][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][Cl][C][Ring1][Branch2]", "smiles": "CNC1CN(S(=O)(=O)Cl)C1" }
3-(methylamino)azetidine-1-sulfonyl chloride
[ { "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": "3-(methylamino)azetidine-1-sulfonyl chloride", "role": "assistant" } ]
297,435
{ "selfies": "[N][C][C][C][C][C][Ring1][Branch1][C][N][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][=C][=O]", "smiles": "NC1CCCC1CNCc1ccc2c(c1)CN(C1CCC(=O)NC1=O)C2=O" }
3-[6-[[(2-aminocyclopentyl)methylamino]methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
[ { "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-[6-[[(2-aminocyclopentyl)methylamino]methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione", "role": "assistant" } ]
297,437
{ "selfies": "[C][Si][Branch1][C][C][Branch1][C][C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch1][C][N][C][C][O][Ring1][Branch2]", "smiles": "C[Si](C)(C)Oc1ccc2c(c1)C(N)CCO2" }
(4R)-6-trimethylsilyloxy-3,4-dihydro-2H-chromen-4-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 represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "(4R)-6-trimethylsilyloxy-3,4-dihydro-2H-chromen-4-amine", "role": "assistant" } ]
297,438
{ "selfies": "[O][=C][C][C][C][Branch2][Ring1][P][N][C][C][=C][C][=C][C][Branch1][S][C][N][C][C][C][C][Branch1][Ring2][C][Ring1][Branch1][N][C][Ring1][#Branch1][=C][Ring1][#C][C][Ring2][Ring1][C][=O][C][=Branch1][C][=O][N][Ring2][Ring1][#Branch2]", "smiles": "O=C1CCC(N2Cc3cccc(CNC45CCC(C4)NC5)c3C2=O)C(=O)N1" }
3-[4-[(2-azabicyclo[2.2.1]heptan-4-ylamino)methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-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": "3-[4-[(2-azabicyclo[2.2.1]heptan-4-ylamino)methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione", "role": "assistant" } ]
297,439
{ "selfies": "[C][O][C][=C][C][=C][Branch1][#Branch2][O][Si][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][N][=C][Ring1][N]", "smiles": "COc1ccc(O[Si](C)(C)C)c(N)c1" }
5-methoxy-2-trimethylsilyloxyaniline
[ { "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": "5-methoxy-2-trimethylsilyloxyaniline", "role": "assistant" } ]
297,440
{ "selfies": "[C][C][C][C][N][Branch2][Ring1][S][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][=C][=O][C][C][C][Ring2][Ring1][=Branch2][N]", "smiles": "CCC1CN(Cc2ccc3c(c2)CN(C2CCC(=O)NC2=O)C3=O)CCC1N" }
3-[6-[(4-amino-3-ethylpiperidin-1-yl)methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-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": "3-[6-[(4-amino-3-ethylpiperidin-1-yl)methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione", "role": "assistant" } ]
297,441
{ "selfies": "[N][C][C][O][C][Branch1][=Branch1][C][Branch1][C][F][F][C][Ring1][Branch2]", "smiles": "NC1COC(C(F)F)C1" }
5-(difluoromethyl)oxolan-3-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": "5-(difluoromethyl)oxolan-3-amine", "role": "assistant" } ]
297,442
{ "selfies": "[N][C][C][C][C][Branch2][Ring1][#C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][=N][=O][C][C][O][Ring2][Ring1][#Branch2]", "smiles": "NCC1CC(NCc2cccc3c2CN(C2CCC(=O)NC2=O)C3=O)CCO1" }
3-[7-[[[(2S,4S)-2-(aminomethyl)oxan-4-yl]amino]methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
[ { "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-[7-[[[(2S,4S)-2-(aminomethyl)oxan-4-yl]amino]methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione", "role": "assistant" } ]
297,443
{ "selfies": "[O][=C][C][C][C][Branch2][Ring1][O][N][C][C][=C][C][=C][Branch1][O][C][N][C][C][=C][C][N][C][Ring1][=Branch1][C][=C][Ring1][=C][C][Ring1][P][=O][C][=Branch1][C][=O][N][Ring2][Ring1][=Branch2]", "smiles": "O=C1CCC(N2Cc3ccc(CNC4C=CCNC4)cc3C2=O)C(=O)N1" }
3-[3-oxo-5-[(1,2,3,6-tetrahydropyridin-3-ylamino)methyl]-1H-isoindol-2-yl]piperidine-2,6-dione
[ { "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": "3-[3-oxo-5-[(1,2,3,6-tetrahydropyridin-3-ylamino)methyl]-1H-isoindol-2-yl]piperidine-2,6-dione", "role": "assistant" } ]
297,444
{ "selfies": "[C][C][C][Branch1][C][N][C][N][Branch2][Ring1][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][=C][C][Ring2][Ring1][Branch2]", "smiles": "CCC1(N)CN(Cc2cccc3c2C(=O)N(C2CCC(=O)NC2=O)C3)C1" }
3-[4-[(3-amino-3-ethylazetidin-1-yl)methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
[ { "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": "3-[4-[(3-amino-3-ethylazetidin-1-yl)methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione", "role": "assistant" } ]
297,445
{ "selfies": "[C][C][C][C][C][C][C][Branch1][Ring1][C][O][N][Ring1][Branch2][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]", "smiles": "CCC1CCCC(CO)N1C(=O)OC(C)(C)C" }
tert-butyl (2R,6R)-2-ethyl-6-(hydroxymethyl)piperidine-1-carboxylate
[ { "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": "tert-butyl (2R,6R)-2-ethyl-6-(hydroxymethyl)piperidine-1-carboxylate", "role": "assistant" } ]
297,446
{ "selfies": "[C][Si][Branch1][C][C][Branch1][C][C][O][C][=C][C][=C][Branch1][Ring1][C][N][C][=C][Ring1][Branch2][O][C][C][Branch1][C][F][F]", "smiles": "C[Si](C)(C)Oc1ccc(CN)cc1OCC(F)F" }
[3-(2,2-difluoroethoxy)-4-trimethylsilyloxyphenyl]methanamine
[ { "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": "[3-(2,2-difluoroethoxy)-4-trimethylsilyloxyphenyl]methanamine", "role": "assistant" } ]
297,447
{ "selfies": "[O][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][C][O][C][C][Branch1][Ring2][C][Ring1][Branch2][C][Ring1][#Branch1][Branch1][C][F][F]", "smiles": "O=C(c1ccccc1)N1CC2COCC(C1)C2(F)F" }
(9,9-difluoro-3-oxa-7-azabicyclo[3.3.1]nonan-7-yl)-phenylmethanone
[ { "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": "(9,9-difluoro-3-oxa-7-azabicyclo[3.3.1]nonan-7-yl)-phenylmethanone", "role": "assistant" } ]
297,448
{ "selfies": "[O][=C][C][C][C][Branch2][Ring2][#Branch2][N][C][C][=C][C][=C][Branch2][Ring1][#Branch1][C][N][Branch1][N][C][=C][C][=N][C][Branch1][C][Cl][=N][Ring1][#Branch1][C][C][C][N][C][Ring1][Branch1][C][=C][Ring2][Ring1][Ring2][C][Ring2][Ring1][#Branch1][=O][C][=Branch1][C][=O][N][Ring2][Ring1][#C]", "smiles": "O=C1CCC(N2Cc3ccc(CN(c4ccnc(Cl)n4)C4CCNC4)cc3C2=O)C(=O)N1" }
3-[5-[[(2-chloropyrimidin-4-yl)-pyrrolidin-3-ylamino]methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
[ { "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-[[(2-chloropyrimidin-4-yl)-pyrrolidin-3-ylamino]methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione", "role": "assistant" } ]
297,449
{ "selfies": "[N][C][C][C][C][Branch2][Ring2][Branch1][C][C][N][Ring1][=Branch1][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][=C][=O][C][Ring2][Ring1][#Branch2]", "smiles": "NCC12CC(CCN1Cc1ccc3c(c1)CN(C1CCC(=O)NC1=O)C3=O)C2" }
3-[6-[[1-(aminomethyl)-2-azabicyclo[3.1.1]heptan-2-yl]methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
[ { "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-[6-[[1-(aminomethyl)-2-azabicyclo[3.1.1]heptan-2-yl]methyl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione", "role": "assistant" } ]
297,450
{ "selfies": "[C][N][C][C][C][N][Branch2][Ring2][Ring1][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][#C][=O][C][C][Ring2][Ring1][=Branch2][C][C][Ring1][Ring1]", "smiles": "CNCC1CN(Cc2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3=O)CC12CC2" }
2-(2,6-dioxopiperidin-3-yl)-5-[[7-(methylaminomethyl)-5-azaspiro[2.4]heptan-5-yl]methyl]isoindole-1,3-dione
[ { "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": "2-(2,6-dioxopiperidin-3-yl)-5-[[7-(methylaminomethyl)-5-azaspiro[2.4]heptan-5-yl]methyl]isoindole-1,3-dione", "role": "assistant" } ]