id
int64
0
300k
molecules
dict
ground_truth
stringlengths
7
2.47k
messages
listlengths
3
3
299,125
{ "selfies": "[C][C][=Branch1][C][=O][O][C][C][C][C][=C][Ring1][Branch1][N][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1][N][Branch1][C][C][C][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C]", "smiles": "CC(=O)OC1CCc2c1nc(Cl)nc2N(C)CC(=O)CC(C)(C)C" }
[2-chloro-4-[(4,4-dimethyl-2-oxopentyl)-methylamino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-yl] acetate
[ { "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-chloro-4-[(4,4-dimethyl-2-oxopentyl)-methylamino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-7-yl] acetate", "role": "assistant" } ]
299,128
{ "selfies": "[C][C][C][C][C][O][C][C][C][C][Branch1][S][C][C][C][C][Branch1][=Branch1][C][C][C][C][C][C][C][Ring1][O][C][Branch1][C][C][C][Ring2][Ring1][C][C]", "smiles": "CCCCCOC1CCC(C2CCC(CCCCC)CC2)C(C)C1C" }
2,3-dimethyl-1-pentoxy-4-(4-pentylcyclohexyl)cyclohexane
[ { "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": "2,3-dimethyl-1-pentoxy-4-(4-pentylcyclohexyl)cyclohexane", "role": "assistant" } ]
299,131
{ "selfies": "[C][=C][C][=C][Branch2][#Branch1][N][C][=C][C][=C][Branch2][=Branch1][S][N][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][C][=C][C][=C][Branch2][Ring2][=C][C][=N][C][Branch2][Ring1][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2][Ring1][=C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring2][Ring1][O][C][=C][Ring2][Ring1][P][C][=C][Ring2][Branch1][Ring2][C][=C][Ring2][Branch1][#Branch2]", "smiles": "c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4nc(-c5ccc6c(c5)Cc5cc7ccccc7cc5-6)c5ccccc5n4)cc3)cc2)cc1" }
N-[4-[4-(11H-benzo[b]fluoren-2-yl)quinazolin-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
[ { "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-[4-[4-(11H-benzo[b]fluoren-2-yl)quinazolin-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline", "role": "assistant" } ]
299,135
{ "selfies": "[C][=C][C][=C][Branch2][#Branch1][Branch2][C][=C][C][=C][C][Branch2][=Branch1][N][C][=C][C][Branch2][Ring2][Branch1][C][=C][C][=C][C][Branch2][Ring1][=Branch2][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][=C][C][Ring1][N][=C][Ring1][#Branch2][Ring1][=Branch1][=C][Ring2][Ring1][=Branch1][=C][C][Branch2][Ring1][=Branch2][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][=C][C][Ring1][N][=C][Ring1][#Branch2][Ring1][=Branch1][=C][Ring2][Ring2][N][=C][Ring2][Branch1][C][C][=C][Ring2][Branch1][Branch2]", "smiles": "c1ccc(-c2cccc(-c3cc(-c4cccc(-c5ccc6ccc7cccc8ccc5c6c78)c4)cc(-c4ccc5ccc6cccc7ccc4c5c67)c3)c2)cc1" }
1,2,3,4,5,6,7,9,10-nonadeuterio-8-[2,3,4,6-tetradeuterio-5-[2,4,6-trideuterio-3-(2,3,4,5,6,7,8,9,10-nonadeuteriopyren-1-yl)-5-[2,3,4,6-tetradeuterio-5-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]phenyl]pyrene
[ { "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": "1,2,3,4,5,6,7,9,10-nonadeuterio-8-[2,3,4,6-tetradeuterio-5-[2,4,6-trideuterio-3-(2,3,4,5,6,7,8,9,10-nonadeuteriopyren-1-yl)-5-[2,3,4,6-tetradeuterio-5-(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]phenyl]pyrene", "role": "assistant" } ]
299,136
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][O][C][=N][C][=C][Branch2][Ring2][Ring2][S][=Branch1][C][=N][=Branch1][C][=O][C][C][=Branch1][C][=O][C][C][=C][Branch1][Branch2][C][C][C][C][C][Ring1][Ring2][C][=C][C][=C][Ring1][O][C][C][C][Ring1][Branch1][S][Ring2][Ring1][#Branch2]", "smiles": "CC(C)(O)c1ncc(S(=N)(=O)CC(=O)Cc2c(CC3CCC3)ccc3c2CCC3)s1" }
1-[5-(cyclobutylmethyl)-2,3-dihydro-1H-inden-4-yl]-3-[[2-(2-hydroxypropan-2-yl)-1,3-thiazol-5-yl]sulfonimidoyl]propan-2-one
[ { "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": "1-[5-(cyclobutylmethyl)-2,3-dihydro-1H-inden-4-yl]-3-[[2-(2-hydroxypropan-2-yl)-1,3-thiazol-5-yl]sulfonimidoyl]propan-2-one", "role": "assistant" } ]
299,139
{ "selfies": "[C][C][O][C][Branch2][Ring2][Ring2][S][=Branch1][C][=N][=Branch1][C][=O][C][C][=Branch1][C][=O][C][C][=C][Branch1][Branch2][C][C][C][C][C][Ring1][Ring2][C][=C][C][=C][Ring1][O][C][C][C][Ring1][Branch1][=C][C][=Ring2][Ring1][#Branch2][C][Branch1][C][C][Branch1][C][C][O]", "smiles": "Cc1oc(S(=N)(=O)CC(=O)Cc2c(CC3CCC3)ccc3c2CCC3)cc1C(C)(C)O" }
1-[5-(cyclobutylmethyl)-2,3-dihydro-1H-inden-4-yl]-3-[[4-(2-hydroxypropan-2-yl)-5-methylfuran-2-yl]sulfonimidoyl]propan-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": "1-[5-(cyclobutylmethyl)-2,3-dihydro-1H-inden-4-yl]-3-[[4-(2-hydroxypropan-2-yl)-5-methylfuran-2-yl]sulfonimidoyl]propan-2-one", "role": "assistant" } ]
299,140
{ "selfies": "[C][C][=C][C][=C][Branch2][=Branch1][Branch2][C][=Branch1][C][=O][N][C][C][N][Branch2][Branch1][Branch2][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][S][N][C][=Branch1][C][=O][C][=C][C][C][=Branch1][C][=O][N][Branch1][C][C][C][=Branch1][C][=O][C][=Ring1][Branch2][C][=C][Ring1][N][C][Ring1][S][=O][C][=C][Ring2][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring2][Ring2][Ring1][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring2][Ring2][#C]", "smiles": "Cc1ccc(C(=O)N2CCN(C(=O)c3ccc(-n4c(=O)c5cc6c(=O)n(C)c(=O)c6cc5c4=O)cc3C(F)(F)F)CC2)c(C(F)(F)F)c1" }
6-methyl-2-[4-[4-[4-methyl-2-(trifluoromethyl)benzoyl]piperazine-1-carbonyl]-3-(trifluoromethyl)phenyl]pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone
[ { "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": "6-methyl-2-[4-[4-[4-methyl-2-(trifluoromethyl)benzoyl]piperazine-1-carbonyl]-3-(trifluoromethyl)phenyl]pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone", "role": "assistant" } ]
299,141
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Branch2][#Branch2][P][N][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N][C][=C][C][Branch2][Ring2][=Branch2][N][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][=C][C][=C][Ring2][Ring1][O][B][Ring2][Ring2][#C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][#Branch2][C][Branch1][C][C][C][C][C][C][C][Ring1][#Branch2][Ring1][#Branch1][C][C][=C][Ring2][#Branch1][C]", "smiles": "CC(C)(C)c1ccc(N(c2ccc(C(C)(C)C)cc2)c2ccc3c(c2)N(c2ccc4c(c2)C(C)(C)c2ccccc2-4)c2cc(N(c4ccc(C(C)(C)C)cc4)c4ccc(C(C)(C)C)cc4)cc4c2B3c2cccc3c2N4C2(C)CCCCC32C)cc1" }
18-N,18-N,24-N,24-N-tetrakis(4-tert-butylphenyl)-21-(9,9-dimethylfluoren-2-yl)-3,8-dimethyl-2,21-diaza-14-boraheptacyclo[12.11.1.12,9.03,8.015,20.022,26.013,27]heptacosa-1(25),9,11,13(27),15(20),16,18,22(26),23-nonaene-18,24-diamine
[ { "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": "18-N,18-N,24-N,24-N-tetrakis(4-tert-butylphenyl)-21-(9,9-dimethylfluoren-2-yl)-3,8-dimethyl-2,21-diaza-14-boraheptacyclo[12.11.1.12,9.03,8.015,20.022,26.013,27]heptacosa-1(25),9,11,13(27),15(20),16,18,22(26),23-nonaene-18,24-diamine", "role": "assistant" } ]
299,142
{ "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][Branch2][C][N][Branch1][C][C][C][=Branch1][C][=O][C][Branch2][=Branch1][P][O][C][C][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][Branch2][Branch1][#Branch1][C][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][C][O][C][C][O][C][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][S][C][N][C][=Branch1][C][=O][C][C][Branch1][C][C][C][Ring1][#Branch1][=O][C][C][Ring1][#C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Branch1][Branch2][C][C][Ring2][=Branch1][C]", "smiles": "CCC1(O)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1cc(F)c(C)c3c1c2C(N(C)C(=O)C1(OCCC(=O)CNC(=O)C(CC(=O)CNC(=O)CCC(=O)COCCOCCNC(=O)C2CCC(CN4C(=O)CC(C)C4=O)CC2)Cc2ccccc2)CC1)CC3" }
N-[2-[2-[5-[[(4R)-4-benzyl-5-[[4-[1-[[(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]-methylcarbamoyl]cyclopropyl]oxy-2-oxobutyl]amino]-2,5-dioxopentyl]amino]-2,5-dioxopentoxy]ethoxy]ethyl]-4-[(3-methyl-2,5-dioxopyrrolidin-1-yl)methyl]cyclohexane-1-carboxamide
[ { "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-[2-[2-[5-[[(4R)-4-benzyl-5-[[4-[1-[[(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]-methylcarbamoyl]cyclopropyl]oxy-2-oxobutyl]amino]-2,5-dioxopentyl]amino]-2,5-dioxopentoxy]ethoxy]ethyl]-4-[(3-methyl-2,5-dioxopyrrolidin-1-yl)methyl]cyclohexane-1-carboxamide", "role": "assistant" } ]
299,146
{ "selfies": "[C][O][C][=C][C][=C][C][Branch2][Branch1][=N][C][=C][Branch1][C][C][N][Branch2][Ring1][Branch1][C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F][C][=Branch1][C][=O][N][Branch2][Ring1][Ring1][C][C][Branch1][#Branch1][C][C][C][C][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring2][C][=O][=C][Ring2][Ring2][=Branch2][F]", "smiles": "COc1cccc(-c2c(C)n(Cc3c(F)cccc3C(F)(F)F)c(=O)n(CC(CCCCC=O)c3ccccc3)c2=O)c1F" }
(6R)-7-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-6-phenylheptanal
[ { "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": "(6R)-7-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-6-phenylheptanal", "role": "assistant" } ]
299,148
{ "selfies": "[C][C][=C][C][=C][Branch1][=C][C][=N][N][Ring1][Branch1][C][C][C][C][C][O][Ring1][=Branch1][C][Branch2][Ring2][Ring2][C][C][Branch1][#Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=N][N][Branch1][=C][C][C][C][Branch1][=Branch1][C][N][C][Ring1][Ring2][C][Ring1][#Branch1][C][=Ring2][Ring1][Ring1][C][=C][Ring2][Ring2][Ring1][Cl]", "smiles": "Cc1cc2c(cnn2C2CCCCO2)c(-c2c(-c3cccnc3C)nn(C3CC4(CNC4)C3)c2C)c1Cl" }
4-[1-(2-azaspiro[3.3]heptan-6-yl)-5-methyl-3-(2-methylpyridin-3-yl)pyrazol-4-yl]-5-chloro-6-methyl-1-(oxan-2-yl)indazole
[ { "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-[1-(2-azaspiro[3.3]heptan-6-yl)-5-methyl-3-(2-methylpyridin-3-yl)pyrazol-4-yl]-5-chloro-6-methyl-1-(oxan-2-yl)indazole", "role": "assistant" } ]
299,152
{ "selfies": "[C][O][C][=C][C][=C][Branch2][Ring2][#Branch2][C][C][=Branch1][C][=O][C][N][Branch1][C][C][C][=N][C][Branch1][P][C][=C][C][Branch1][#Branch1][O][C][Branch1][C][F][F][=C][C][=N][Ring1][#Branch2][=N][C][=C][Ring1][S][C][C][C][Ring1][Branch1][C][=N][Ring2][Ring1][#C]", "smiles": "COc1ccc(CC(=O)CN(C)c2nc(-c3cc(OC(F)F)ccn3)nc3c2CCC3)cn1" }
1-[[2-[4-(difluoromethoxy)pyridin-2-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]-methylamino]-3-(6-methoxypyridin-3-yl)propan-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": "1-[[2-[4-(difluoromethoxy)pyridin-2-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]-methylamino]-3-(6-methoxypyridin-3-yl)propan-2-one", "role": "assistant" } ]
299,155
{ "selfies": "[C][C][C][C][Branch1][=N][O][C][C][O][C][C][C][C][C][O][Ring1][=Branch1][C][C][Branch1][Branch2][O][C][C][C][O][Ring1][Ring1][C][Ring2][Ring1][Branch1]", "smiles": "CC1CC(OCCOC2CCCCO2)CC(OCC2CO2)C1" }
2-[2-[3-methyl-5-(oxiran-2-ylmethoxy)cyclohexyl]oxyethoxy]oxane
[ { "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-[3-methyl-5-(oxiran-2-ylmethoxy)cyclohexyl]oxyethoxy]oxane", "role": "assistant" } ]
299,156
{ "selfies": "[C][=C][C][=C][Branch2][#Branch2][Branch2][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring2][N][C][=C][C][=C][Branch2][Ring1][S][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring2][Ring1][Ring2][Ring1][=Branch1][C][=C][Ring2][Ring1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][B][Ring2][Ring2][Branch1][C][=C][C][=C][Branch1][=Branch2][C][=C][Ring1][=Branch1][O][Ring2][Ring2][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][=C][Ring1][N][B][Ring2][Ring1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][#Branch1][=Branch1]", "smiles": "c1ccc(-c2cc3c4c(c2)N(c2ccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)cc2)c2ccccc2B4c2cc4c(cc2O3)N(c2ccccc2)c2cc(-c3ccccc3)cc3c2B4c2ccccc2N3c2ccccc2)cc1" }
15,22,25,28-tetraphenyl-12-[4-(10-phenylanthracen-9-yl)phenyl]-18-oxa-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene
[ { "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": "15,22,25,28-tetraphenyl-12-[4-(10-phenylanthracen-9-yl)phenyl]-18-oxa-12,22,28-triaza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene", "role": "assistant" } ]
299,159
{ "selfies": "[C-1][#N+1][C][=C][C][=C][Branch2][Ring1][Ring2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=N][C][=C][Ring2][Ring1][Ring1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=C][Branch2][Ring1][Ring2][N][O][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][=Branch2][C][=C][C][Ring1][#C][O][Ring2][Ring1][Ring1]", "smiles": "[C-]#[N+]c1ccc(-n2c3ccccc3c3ccccc32)cc1-c1ccc2c(c1)C1C=C(N3OC(C)(C)C(C)(C)O3)C=CC1O2" }
2-[8-(5-carbazol-9-yl-2-isocyanophenyl)-4a,9b-dihydrodibenzofuran-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxazolidine
[ { "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-[8-(5-carbazol-9-yl-2-isocyanophenyl)-4a,9b-dihydrodibenzofuran-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxazolidine", "role": "assistant" } ]
299,162
{ "selfies": "[C][N][N][=C][C][=Branch2][Ring1][Branch1][=C][Ring1][Branch1][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][=Branch2][C][C][C][C][C][C][Ring2][Ring1][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=N][N][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=Ring1][=Branch2][C][Branch1][C][F][Branch1][C][F][F]", "smiles": "Cn1nc2c(c1-c1cc(F)c(F)c(F)c1)CC1CCCC2N1C(=O)c1cnn(C(C)(C)C)c1C(F)(F)F" }
[1-tert-butyl-5-(trifluoromethyl)pyrazol-4-yl]-[(1R,8R)-4-methyl-5-(3,4,5-trifluorophenyl)-3,4,12-triazatricyclo[6.3.1.02,6]dodeca-2,5-dien-12-yl]methanone
[ { "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-tert-butyl-5-(trifluoromethyl)pyrazol-4-yl]-[(1R,8R)-4-methyl-5-(3,4,5-trifluorophenyl)-3,4,12-triazatricyclo[6.3.1.02,6]dodeca-2,5-dien-12-yl]methanone", "role": "assistant" } ]
299,163
{ "selfies": "[C][C][=C][C][=N][C][=C][Branch2][Branch1][=N][C][=C][N][=C][Branch2][Branch1][C][C][=C][C][Branch1][O][C][=C][C][O][C][C][Ring1][Branch1][=C][C][=C][Branch1][Ring1][C][#Os][P+1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring2][Ring2][=Branch1][S][Ring2][Ring2][O]", "smiles": "CC=Cc1ncc(-c2cnc(C=CC(C=C3COCC3=CC)=C(C#[Os])[P+](c3ccccc3)(c3ccccc3)c3ccccc3)s2)s1" }
[(4E)-3-[(4-ethylideneoxolan-3-ylidene)methyl]-5-[5-[2-[(E)-prop-1-enyl]-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]-2-triphenylphosphaniumylpenta-2,4-dienylidyne]osmium
[ { "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": "[(4E)-3-[(4-ethylideneoxolan-3-ylidene)methyl]-5-[5-[2-[(E)-prop-1-enyl]-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]-2-triphenylphosphaniumylpenta-2,4-dienylidyne]osmium", "role": "assistant" } ]
299,164
{ "selfies": "[N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][Ring1][N][C][=N][C][=C][C][=C][N][Branch1][#Branch1][C][Ring1][Branch1][=N][Ring1][=Branch2][C][Branch1][Branch2][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][Ring1][=C][N][=C][Ring2][Ring1][#Branch2]", "smiles": "NS(=O)(=O)c1ccc(Nc2ncc3cc4n(c3n2)C2(CCCCC2)C(=O)NC4)nc1" }
6-[(12-oxospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-4-yl)amino]pyridine-3-sulfonamide
[ { "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-[(12-oxospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-4-yl)amino]pyridine-3-sulfonamide", "role": "assistant" } ]
299,166
{ "selfies": "[C][=C][C][=C][Branch2][Branch1][#C][C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Branch2][Ring2][=Branch1][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=C][C][=C][C][O][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][C][=C][Ring1][#Branch2][C][Ring1][P][=Ring1][=N][C][=C][Ring2][Ring1][#Branch1][C][=C][C][=C][C][=C][Ring2][Ring2][Branch1][Ring1][=Branch1][C][=C][Ring2][Ring2][N]", "smiles": "c1ccc(Cc2c3ccccc3c(-c3ccc(-c4cccc5oc6c7ccccc7ccc6c45)cc3)c3ccccc23)cc1" }
1,2,3,4,5,6,8,9,10-nonadeuterio-7-[2,3,5,6-tetradeuterio-4-[1,2,3,4,5,6,7,8-octadeuterio-10-[(2,3,4,5,6-pentadeuteriophenyl)methyl]anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran
[ { "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": "1,2,3,4,5,6,8,9,10-nonadeuterio-7-[2,3,5,6-tetradeuterio-4-[1,2,3,4,5,6,7,8-octadeuterio-10-[(2,3,4,5,6-pentadeuteriophenyl)methyl]anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran", "role": "assistant" } ]
299,170
{ "selfies": "[C][C][C][C][C][O][C][C][C][C][Branch1][S][O][C][C][C][C][C][Branch1][Ring2][C][C][C][C][C][Ring1][=Branch2][C][Branch1][C][C][C][Ring2][Ring1][C][C]", "smiles": "CCCCCOC1CCC(OCC2CCC(CCC)CC2)C(C)C1C" }
2,3-dimethyl-1-pentoxy-4-[(4-propylcyclohexyl)methoxy]cyclohexane
[ { "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": "2,3-dimethyl-1-pentoxy-4-[(4-propylcyclohexyl)methoxy]cyclohexane", "role": "assistant" } ]
299,171
{ "selfies": "[C][C][=Branch1][=C][=N][S][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][O][C][Branch1][Branch1][C][N][=N+1][=N-1][C][O][Ring1][#Branch2]", "smiles": "CC(=NS(=O)C(C)(C)C)c1cc(F)cc2c1OC(CN=[N+]=[N-])CO2" }
(R)-N-[1-[(3R)-3-(azidomethyl)-7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl]ethylidene]-2-methylpropane-2-sulfinamide
[ { "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": "(R)-N-[1-[(3R)-3-(azidomethyl)-7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl]ethylidene]-2-methylpropane-2-sulfinamide", "role": "assistant" } ]
299,172
{ "selfies": "[C][C][=C][C][Branch1][C][C][=C][C][=Branch1][Branch1][=C][Ring1][#Branch1][C][N][Branch1][C][C][C][Branch1][C][C][N][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][P][Ring1][O][C]", "smiles": "Cc1cc(C)c2c(c1C)N(C)C1(C)N(C)C(C)(C)C(C)(C)C21C" }
1,1,2,2,3,3a,4,5,6,8,8b-undecamethylpyrrolo[2,3-b]indole
[ { "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": "1,1,2,2,3,3a,4,5,6,8,8b-undecamethylpyrrolo[2,3-b]indole", "role": "assistant" } ]
299,176
{ "selfies": "[C][N][C][N][Branch2][Branch2][#C][C][=C][C][=C][C][Branch2][Branch2][Ring1][O][C][=C][C][=C][C][Branch2][#Branch1][=Branch1][N][C][N][Branch2][=Branch1][Branch1][C][=C][N][=C][Branch2][Branch1][=Branch2][N][C][N][Branch2][Ring2][Branch2][C][=C][C][=C][C][Branch2][Ring1][N][O][C][=C][C][=C][C][Branch1][P][N][C][N][Branch1][C][C][C][=C][N][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][=C][Ring1][S][=C][Ring2][Ring1][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][S][C][=N][Ring2][Ring2][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring2][#C][=C][Ring2][Branch1][Branch1][=C][Ring2][Branch1][N][C][=C][C][=N][C][=C][Ring1][=Branch1][Ring2][=Branch1][Branch1]", "smiles": "CN1CN(c2cccc(Oc3cccc(N4CN(c5cnc(N6CN(c7cccc(Oc8cccc(N9CN(C)c%10cnccc%109)c8)c7)c7ccccc76)cn5)c5ccccc54)c3)c2)c2ccncc21" }
1-[3-[3-[3-[5-[3-[3-[3-(3-methyl-2H-imidazo[4,5-c]pyridin-1-yl)phenoxy]phenyl]-2H-benzimidazol-1-yl]pyrazin-2-yl]-2H-benzimidazol-1-yl]phenoxy]phenyl]-3-(trideuteriomethyl)-2H-imidazo[4,5-c]pyridine
[ { "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-[3-[3-[3-[5-[3-[3-[3-(3-methyl-2H-imidazo[4,5-c]pyridin-1-yl)phenoxy]phenyl]-2H-benzimidazol-1-yl]pyrazin-2-yl]-2H-benzimidazol-1-yl]phenoxy]phenyl]-3-(trideuteriomethyl)-2H-imidazo[4,5-c]pyridine", "role": "assistant" } ]
299,183
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Branch2][O][Ring1][N][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][B][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch2][#Branch1][#Branch1][C][=C][C][Branch2][Ring2][=Branch2][N][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][=C][C][=Branch1][Branch2][=C][Ring2][Ring1][O][Ring2][Ring2][Ring1][N][Ring2][Ring2][#Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][Branch1][C][C][C][C][Branch1][C][C][C][C][C][C][C][Ring2][Branch1][Branch1][Ring1][#Branch1][C][C][=C][Ring2][#Branch1][C]", "smiles": "CC(C)(C)c1ccc(N(c2ccc(C(C)(C)C)cc2)c2ccc3c(c2)B2c4cccc5c4N(c4cc(N(c6ccc(C(C)(C)C)cc6)c6ccc(C(C)(C)C)cc6)cc(c42)N3c2ccc3c(c2)-c2ccccc2C3(C)C)C2(C)CCCCC52C)cc1" }
17-N,17-N,24-N,24-N-tetrakis(4-tert-butylphenyl)-21-(9,9-dimethylfluoren-3-yl)-3,8-dimethyl-2,21-diaza-14-boraheptacyclo[12.11.1.12,9.03,8.015,20.022,26.013,27]heptacosa-1(25),9,11,13(27),15(20),16,18,22(26),23-nonaene-17,24-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": "17-N,17-N,24-N,24-N-tetrakis(4-tert-butylphenyl)-21-(9,9-dimethylfluoren-3-yl)-3,8-dimethyl-2,21-diaza-14-boraheptacyclo[12.11.1.12,9.03,8.015,20.022,26.013,27]heptacosa-1(25),9,11,13(27),15(20),16,18,22(26),23-nonaene-17,24-diamine", "role": "assistant" } ]
299,184
{ "selfies": "[C][C][=C][C][=C][Branch1][C][C][C][Branch2][Ring1][P][N][C][=C][C][O][C][=C][Branch1][C][C][N][=C][C][=C][Ring1][#Branch1][C][=Ring1][#Branch2][C][=C][Ring1][=C][N][Branch1][C][C][C][Ring2][Ring1][C][C][=C][Ring2][Ring1][#Branch2]", "smiles": "Cc1ccc(C)c(N2c3cc4oc5c(C)nccc5c4cc3N(C)C2C)c1" }
(13S)-12-(2,5-dimethylphenyl)-6,13,14-trimethyl-8-oxa-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15)-hexaene
[ { "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": "(13S)-12-(2,5-dimethylphenyl)-6,13,14-trimethyl-8-oxa-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15)-hexaene", "role": "assistant" } ]
299,191
{ "selfies": "[O][=C][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][C][C][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][N][C][=Branch1][C][=O][C][Branch1][P][C][C][N][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][C][Ring2][Ring2][=Branch1]", "smiles": "O=C1CCc2cccc(c2)OCCCCC(C(=O)NC2CCCC2)NC(=O)C(CCN2CCC(F)(F)CC2)C1" }
(7S,10R)-N-cyclopentyl-10-[2-(4,4-difluoropiperidin-1-yl)ethyl]-9,12-dioxo-2-oxa-8-azabicyclo[13.3.1]nonadeca-1(18),15(19),16-triene-7-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": "(7S,10R)-N-cyclopentyl-10-[2-(4,4-difluoropiperidin-1-yl)ethyl]-9,12-dioxo-2-oxa-8-azabicyclo[13.3.1]nonadeca-1(18),15(19),16-triene-7-carboxamide", "role": "assistant" } ]
299,216
{ "selfies": "[C][C][Branch1][N][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=Branch2][Ring2][=Branch2][=C][C][Ring2][Ring1][Branch1][=C][C][=Branch1][Branch2][=C][Ring2][Ring1][#Branch1][Ring2][Ring1][Ring1][C][Ring2][Ring1][Ring1][=C][Ring1][P][C][=Branch1][#Branch1][=C][Ring2][Ring1][C][Ring1][=C][C][Ring1][Branch2][=C][Ring1][#C][Ring1][O][C][Ring2][Ring2][Branch2][Ring2][Ring1][S][C][Branch1][#Branch2][C][C][C][Ring2][Ring1][P][Ring2][Ring2][Ring2][C][Ring2][Ring1][Ring1][C][C][C][Ring2][Ring1][#Branch2][Ring2][Ring1][#Branch1]", "smiles": "CC1(c2ccc(N)cc2)C23c4c5c6ccc7c8ccc9c%10ccc%11c%12c%13c%14c%15c(c%16c4c4c(c57)c8c9c(c%10%12)c4c%13%16)C12C(CCC63)C%15CCC%11%14" }
4-(34-methyl-34-heptadecacyclo[10.8.8.821,28.523,26.04,22.05,24.08,25.09,27.013,30.016,31.017,33.020,35.029,38.032,39.033,35.036,40.037,41]hentetraconta-1(21),2,4,6,8,10,12(28),22,24,26,29(38),30,32(39),36(40),37(41)-pentadecaenyl)aniline
[ { "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-(34-methyl-34-heptadecacyclo[10.8.8.821,28.523,26.04,22.05,24.08,25.09,27.013,30.016,31.017,33.020,35.029,38.032,39.033,35.036,40.037,41]hentetraconta-1(21),2,4,6,8,10,12(28),22,24,26,29(38),30,32(39),36(40),37(41)-pentadecaenyl)aniline", "role": "assistant" } ]
299,217
{ "selfies": "[C][C][C][N][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][N][Branch1][#Branch1][C][C][C][C][O][C][C][Ring1][=N][=O][C][C][Branch2][Ring2][=C][C][=C][C][=C][Branch2][Ring2][C][N][Branch1][=N][C][C][C][N][C][=C][C][=C][C][Ring1][=Branch1][=O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][N][=C][Ring2][Ring1][O][=N][Ring2][Ring2][O]", "smiles": "CCCn1c2c(c(=O)n(CCCCOC)c1=O)CC(c1ccc(N(CCCn3ccccc3=O)C(=O)c3ccc(F)c(F)c3)nc1)=N2" }
3,4-difluoro-N-[5-[3-(4-methoxybutyl)-2,4-dioxo-1-propyl-5H-pyrrolo[2,3-d]pyrimidin-6-yl]pyridin-2-yl]-N-[3-(2-oxopyridin-1-yl)propyl]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": "3,4-difluoro-N-[5-[3-(4-methoxybutyl)-2,4-dioxo-1-propyl-5H-pyrrolo[2,3-d]pyrimidin-6-yl]pyridin-2-yl]-N-[3-(2-oxopyridin-1-yl)propyl]benzamide", "role": "assistant" } ]
299,219
{ "selfies": "[C][C][Branch1][C][F][C][O][C][=N][O][N][=C][Ring1][Branch1][C][Branch1][C][C][Branch1][C][C][C]", "smiles": "CC(F)COc1nonc1C(C)(C)C" }
3-tert-butyl-4-(2-fluoropropoxy)-1,2,5-oxadiazole
[ { "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-tert-butyl-4-(2-fluoropropoxy)-1,2,5-oxadiazole", "role": "assistant" } ]
299,221
{ "selfies": "[C][C][N][C][Branch1][=C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Branch1][C][C][C][=C][C][=C][C][=Branch1][=Branch2][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][Branch2][Ring2][S][N][C][=Branch1][C][=O][C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][N][C][Ring1][Ring1][C][C][C][Ring1][Ring1][C][C][Ring1][=N][C][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(-c2cccnc2C(C)C)c2c3cc(ccc31)-c1cccc(c1)CC(NC(=O)C(C1CCCC1)N(C)C(=O)C1CN(C(=O)C3NC3C3CC3)CC1C)C(=O)N1CCCC(N1)C(=O)OCC(C)(C)C2" }
(3R,4S)-N-[(1S)-1-cyclopentyl-2-[[(8S,14S)-22-ethyl-18,18-dimethyl-9,15-dioxo-21-(2-propan-2-ylpyridin-3-yl)-16-oxa-10,22,28-triazapentacyclo[18.5.2.12,6.110,14.023,27]nonacosa-1(26),2,4,6(29),20,23(27),24-heptaen-8-yl]amino]-2-oxoethyl]-1-[(2R,3R)-3-cyclopropylaziridine-2-carbonyl]-N,4-dimethylpyrrolidine-3-carboxamide
[ { "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": "(3R,4S)-N-[(1S)-1-cyclopentyl-2-[[(8S,14S)-22-ethyl-18,18-dimethyl-9,15-dioxo-21-(2-propan-2-ylpyridin-3-yl)-16-oxa-10,22,28-triazapentacyclo[18.5.2.12,6.110,14.023,27]nonacosa-1(26),2,4,6(29),20,23(27),24-heptaen-8-yl]amino]-2-oxoethyl]-1-[(2R,3R)-3-cyclopropylaziridine-2-carbonyl]-N,4-dimethylpyrrolidine-3-carboxamide", "role": "assistant" } ]
299,225
{ "selfies": "[C][C][=C][Branch2][Ring1][N][N][C][=N][C][=C][Branch1][C][F][C][Branch1][=C][O][C][C][C][C][C][Branch1][C][C][C][C][Ring1][#Branch1][=N][Ring1][S][C][=N][N][Ring2][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][C][#N]", "smiles": "Cc1c(Nc2ncc(F)c(OCC3CCC(C)CC3)n2)cnn1C(C)(C)C#N" }
2-[4-[[5-fluoro-4-[(4-methylcyclohexyl)methoxy]pyrimidin-2-yl]amino]-5-methylpyrazol-1-yl]-2-methylpropanenitrile
[ { "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-[4-[[5-fluoro-4-[(4-methylcyclohexyl)methoxy]pyrimidin-2-yl]amino]-5-methylpyrazol-1-yl]-2-methylpropanenitrile", "role": "assistant" } ]
299,229
{ "selfies": "[C][=C][C][=C][Branch2][Branch2][=Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Branch2][=Branch1][=C][C][=C][C][=C][C][Branch2][=Branch1][C][N][Branch2][Ring2][#Branch2][C][=C][C][=C][Branch2][Ring1][=C][Si][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch2][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=C][Ring1][=Branch1][=C][Ring2][Ring2][=C][C][=C][C][=C][Ring2][Branch1][Ring2][Ring2][Branch1][O][C][=C][Ring2][Branch1][P]", "smiles": "c1ccc(-n2c3ccccc3c3c(-c4cccc(N(c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc5)c5cc6ccccc6c6ccccc56)c4)cccc32)cc1" }
N-[3-(9-phenylcarbazol-4-yl)phenyl]-N-(4-triphenylsilylphenyl)phenanthren-9-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": "N-[3-(9-phenylcarbazol-4-yl)phenyl]-N-(4-triphenylsilylphenyl)phenanthren-9-amine", "role": "assistant" } ]
299,231
{ "selfies": "[C][C][Branch1][Ring1][C][#N][=C][N][C][=C][Branch2][=Branch1][P][C][Branch2][Ring1][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=Branch2][Ring1][#C][=C][Ring2][Ring1][Ring2][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][Branch1][C][F][Branch1][C][F][F][O][C][=Branch1][Branch2][=C][Branch1][Ring1][C][#N][C][#N][N][Ring2][Ring1][=Branch2][O][Ring2][Ring2][=N]", "smiles": "CC(C#N)=C1Nc2c(c(-c3ccc(C(F)(F)F)cc3C(F)(F)F)c3c(c2-c2ccc(C(F)(F)F)cc2C(F)(F)F)OC(=C(C#N)C#N)N3)O1" }
2-[(6Z)-4,8-bis[2,4-bis(trifluoromethyl)phenyl]-6-(1-cyanoethylidene)-3,7-dihydro-[1,3]oxazolo[5,4-f][1,3]benzoxazol-2-ylidene]propanedinitrile
[ { "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-[(6Z)-4,8-bis[2,4-bis(trifluoromethyl)phenyl]-6-(1-cyanoethylidene)-3,7-dihydro-[1,3]oxazolo[5,4-f][1,3]benzoxazol-2-ylidene]propanedinitrile", "role": "assistant" } ]
299,237
{ "selfies": "[C][N][=C][Branch1][C][N][N][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C]", "smiles": "CN=C(N)NC(=O)NC(C)(C)C" }
1-tert-butyl-3-(N'-methylcarbamimidoyl)urea
[ { "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-tert-butyl-3-(N'-methylcarbamimidoyl)urea", "role": "assistant" } ]
299,248
{ "selfies": "[O][=C][C][C][C][Branch2][#Branch1][P][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][=Branch1][O][N][C][C][N][Branch2][Branch1][#C][C][C][C][C][C][C][C][N][C][C][C][Branch2][Ring2][N][C][C][=N][C][=N][C][NH1][C][=C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=N][Cl][C][Ring2][Ring1][=Branch2][=Ring2][Ring1][Branch1][C][C][Ring2][Ring1][S][C][C][Ring2][Ring2][=N][C][=C][Ring2][Branch1][Ring1][C][Ring2][Branch1][#Branch1][=O][C][=Branch1][C][=O][C][Ring2][Branch1][#C]", "smiles": "O=C1CCC(N2C(=O)c3ccc(N4CCN(CCCCCCCN5CCC(Cc6ncnc7[nH]cc(C(=O)c8ccc(Oc9ccccc9)cc8Cl)c67)CC5)CC4)cc3C2=O)C(=O)C1" }
5-[4-[7-[4-[[5-(2-chloro-4-phenoxybenzoyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]methyl]piperidin-1-yl]heptyl]piperazin-1-yl]-2-(2,4-dioxocyclohexyl)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": "5-[4-[7-[4-[[5-(2-chloro-4-phenoxybenzoyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]methyl]piperidin-1-yl]heptyl]piperazin-1-yl]-2-(2,4-dioxocyclohexyl)isoindole-1,3-dione", "role": "assistant" } ]
299,251
{ "selfies": "[C][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][Branch1][C][C][C][C][=Branch1][C][=O][C][Branch1][Branch1][C][C][S][C][N][C][=Branch1][C][=O][C][C][C][C][N][Ring1][Branch1]", "smiles": "COC(=O)CCC(=O)CNC(=O)C(C)CC(=O)C(CCSC)NC(=O)C1CCCN1" }
methyl 5-[[(2R,5S)-2-methyl-7-methylsulfanyl-4-oxo-5-[[(2S)-pyrrolidine-2-carbonyl]amino]heptanoyl]amino]-4-oxopentanoate
[ { "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": "methyl 5-[[(2R,5S)-2-methyl-7-methylsulfanyl-4-oxo-5-[[(2S)-pyrrolidine-2-carbonyl]amino]heptanoyl]amino]-4-oxopentanoate", "role": "assistant" } ]
299,253
{ "selfies": "[C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][=C][Ring1][N][N][Ring1][#C][C][=C][C][=C][C][=C][O][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][C][Ring1][#Branch2][=C][C][Ring1][=C][=C][Ring2][Ring1][C]", "smiles": "COc1ccc(Cl)c2c1c1cc(-c3ccccc3)ccc1n2-c1ccc2cc3oc4cc(C)ccc4c3cc2c1" }
1-chloro-4-methoxy-9-(3-methylnaphtho[2,3-b][1]benzofuran-9-yl)-6-phenylcarbazole
[ { "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": "1-chloro-4-methoxy-9-(3-methylnaphtho[2,3-b][1]benzofuran-9-yl)-6-phenylcarbazole", "role": "assistant" } ]
299,256
{ "selfies": "[C][C][O][C][=Branch1][C][=O][C][Branch1][C][C][O][C][C][Branch1][C][C][N][C][C][C][C][Branch2][Ring2][=Branch2][C][C][=C][C][Branch2][Ring1][=Branch2][C][=C][C][=C][C][Branch1][#C][N][C][C][Branch1][Ring1][C][#N][C][C][O][C][C][Ring1][Branch2][=N][Ring1][S][=C][Branch1][C][C][C][=N][Ring2][Ring1][#Branch1][C][C][Ring2][Ring1][=C]", "smiles": "CCOC(=O)C(C)OCC(C)NC1CCC(Cc2cc(-c3cccc(NCC4(C#N)CCOCC4)n3)c(C)cn2)CC1" }
ethyl (2R)-2-[(2S)-2-[[4-[[4-[6-[(4-cyanooxan-4-yl)methylamino]pyridin-2-yl]-5-methylpyridin-2-yl]methyl]cyclohexyl]amino]propoxy]propanoate
[ { "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": "ethyl (2R)-2-[(2S)-2-[[4-[[4-[6-[(4-cyanooxan-4-yl)methylamino]pyridin-2-yl]-5-methylpyridin-2-yl]methyl]cyclohexyl]amino]propoxy]propanoate", "role": "assistant" } ]
299,261
{ "selfies": "[O][C][C][C][O][C][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring2][Ring1][C]", "smiles": "OCC1COC(Cn2cncn2)(c2ccc(F)cc2)C1" }
[(3R,5R)-5-(4-fluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methanol
[ { "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,5R)-5-(4-fluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methanol", "role": "assistant" } ]
299,262
{ "selfies": "[C][N+1][=C][C][=C][Branch2][Ring1][=C][C][Branch1][=C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch2]", "smiles": "C[n+]1ccc(C(c2c[nH]c3ccccc23)c2c[nH]c3ccccc23)cc1" }
3-[1H-indol-3-yl-(1-methylpyridin-1-ium-4-yl)methyl]-1H-indole
[ { "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-[1H-indol-3-yl-(1-methylpyridin-1-ium-4-yl)methyl]-1H-indole", "role": "assistant" } ]
299,263
{ "selfies": "[C][C][=C][Branch2][Ring2][Branch1][C][=C][C][=C][C][C][C][Branch1][C][C][C][Ring1][#Branch1][C][C][C][Ring1][=Branch1][C][Branch1][C][C][C][=C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][O][C][C][Branch1][C][O][C][C][Ring2][Ring1][=N]", "smiles": "CC1=C(C=CC2=CCCC3(C)C2CCC3C(C)C=CC(C)C(C)(C)O)CC(O)CC1" }
3-[(E)-2-[1-[(E)-6-hydroxy-5,6-dimethylhept-3-en-2-yl]-7a-methyl-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methylcyclohex-3-en-1-ol
[ { "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-[(E)-2-[1-[(E)-6-hydroxy-5,6-dimethylhept-3-en-2-yl]-7a-methyl-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methylcyclohex-3-en-1-ol", "role": "assistant" } ]
299,264
{ "selfies": "[C][N][C][C][=C][C][=C][C][Branch1][C][Cl][=C][C][=N][C][Ring1][#Branch1][=N][Ring1][O]", "smiles": "CNCc1ccc2c(Cl)ccnc2n1" }
1-(5-chloro-1,8-naphthyridin-2-yl)-N-methylmethanamine
[ { "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-(5-chloro-1,8-naphthyridin-2-yl)-N-methylmethanamine", "role": "assistant" } ]
299,265
{ "selfies": "[N][C][C][C][C][N][Branch2][Ring2][#C][C][C][C][N][Branch2][Ring2][C][C][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][N][Ring2][Ring1][#Branch2][C][C][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][Ring1][#Branch2]", "smiles": "NCCCCN(CC1CN(CCC(NC(=O)C2CCC(F)(F)CC2)c2ccccc2)CCN1)C1CCCc2cccnc21" }
N-[(1S)-3-[3-[[4-aminobutyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]methyl]piperazin-1-yl]-1-phenylpropyl]-4,4-difluorocyclohexane-1-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 represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "N-[(1S)-3-[3-[[4-aminobutyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]methyl]piperazin-1-yl]-1-phenylpropyl]-4,4-difluorocyclohexane-1-carboxamide", "role": "assistant" } ]
299,266
{ "selfies": "[C][C][Branch1][C][C][N][Branch1][S][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O]", "smiles": "CC(C)N(c1ccc(C(=O)O)cc1)S(C)(=O)=O" }
4-[methylsulfonyl(propan-2-yl)amino]benzoic 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-[methylsulfonyl(propan-2-yl)amino]benzoic acid", "role": "assistant" } ]
299,268
{ "selfies": "[C][=C][C][C][Branch2][Ring1][#Branch2][C][O][C][=C][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][N][Cl][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]", "smiles": "C=CCC(COc1cc(C(N)=O)cc([N+](=O)[O-])c1Cl)NC(=O)OC(C)(C)C" }
tert-butyl N-[1-(5-carbamoyl-2-chloro-3-nitrophenoxy)pent-4-en-2-yl]carbamate
[ { "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": "tert-butyl N-[1-(5-carbamoyl-2-chloro-3-nitrophenoxy)pent-4-en-2-yl]carbamate", "role": "assistant" } ]
299,270
{ "selfies": "[C][C][=C][C][=C][Branch2][Branch1][Ring2][C][=C][Branch1][C][C][C][=C][N][=C][Branch2][Ring1][Ring2][N][C][=C][C][=C][Branch1][=Branch2][N][C][C][N][C][C][Ring1][=Branch1][C][=N][Ring1][N][N][=C][Ring2][Ring1][Ring1][N][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][C][Ring2][Ring1][=N][=O][C][=C][Ring2][Ring2][Ring2]", "smiles": "Cc1ccc(-c2c(C)c3cnc(Nc4ccc(N5CCNCC5)cn4)nc3n(C3CCCC3)c2=O)cc1" }
8-cyclopentyl-5-methyl-6-(4-methylphenyl)-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrido[2,3-d]pyrimidin-7-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": "8-cyclopentyl-5-methyl-6-(4-methylphenyl)-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrido[2,3-d]pyrimidin-7-one", "role": "assistant" } ]
299,271
{ "selfies": "[C][C][Branch1][C][O][C][N][C][C][C][C][C][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1]", "smiles": "CC(O)CN1CC2CCC(C1)N2" }
(2S)-1-(3,8-diazabicyclo[3.2.1]octan-3-yl)propan-2-ol
[ { "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": "(2S)-1-(3,8-diazabicyclo[3.2.1]octan-3-yl)propan-2-ol", "role": "assistant" } ]
299,272
{ "selfies": "[C][O][C][=C][C][=C][Branch2][#Branch1][=Branch1][C][=C][N][=C][Branch2][=Branch1][#Branch2][C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][=C][C][=C][C][Branch1][Ring2][NH1][Ring1][Branch1][=C][Branch1][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=N][C][=Branch2][Ring1][=Branch2][=C][Branch1][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=C][C][=C][Ring2][Ring2][=Branch2][NH1][Ring1][Branch1][C][=C][Ring2][Ring1][C][C][=C][Ring2][Ring2][=N][C][=C][Ring2][Branch1][Ring2]", "smiles": "COc1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4ccc([nH]4)c(-c4ccc(O)cc4)c4nc(c(-c5ccc(O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1" }
4-[10-(4-hydroxyphenyl)-15,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]phenol
[ { "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-[10-(4-hydroxyphenyl)-15,20-bis(4-methoxyphenyl)-21,23-dihydroporphyrin-5-yl]phenol", "role": "assistant" } ]
299,273
{ "selfies": "[N][C][=C][C][=C][Branch1][O][O][C][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=C][Ring1][#C]", "smiles": "Nc1ccc(OCC(F)(F)F)c(C2CC2)c1" }
3-cyclopropyl-4-(2,2,2-trifluoroethoxy)aniline
[ { "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-cyclopropyl-4-(2,2,2-trifluoroethoxy)aniline", "role": "assistant" } ]
299,275
{ "selfies": "[C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][I][C][=C][Ring1][#Branch1][C][C][N][Ring1][P][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C]", "smiles": "CC1CN(C(=O)COc2ccc(I)cc2)CCN1C(=O)OC(C)(C)C" }
tert-butyl (2S)-4-[2-(4-iodophenoxy)acetyl]-2-methylpiperazine-1-carboxylate
[ { "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": "tert-butyl (2S)-4-[2-(4-iodophenoxy)acetyl]-2-methylpiperazine-1-carboxylate", "role": "assistant" } ]
299,276
{ "selfies": "[C][C][Branch1][C][C][=C][C][C][Branch1][C][O][C][Branch1][C][O][C][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][C][Branch1][C][O][=C][Ring1][Branch2][C][Ring1][=C][=O]", "smiles": "CC(C)=CCC(O)C1(O)CC(=O)c2c(O)ccc(O)c2C1=O" }
3,5,8-trihydroxy-3-[(1R)-1-hydroxy-4-methylpent-3-enyl]-2H-naphthalene-1,4-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": "3,5,8-trihydroxy-3-[(1R)-1-hydroxy-4-methylpent-3-enyl]-2H-naphthalene-1,4-dione", "role": "assistant" } ]
299,277
{ "selfies": "[C][O][C][=Branch1][C][=O][C][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][Branch1][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1]", "smiles": "COC(=O)C(C)NC(=O)C(Cc1ccccc1)NC(=O)C(N)Cc1ccccc1" }
methyl (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]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": "methyl (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]propanoate", "role": "assistant" } ]
299,278
{ "selfies": "[C][C][C][=C][C][=C][N][=C][C][Branch1][Ring1][C][#N][=C][Branch2][Ring1][#C][C][C][N][C][C][C][Branch2][Ring1][C][N][C][C][=C][C][=C][Branch1][Branch1][C][=N][Ring1][=Branch1][O][C][S][Ring1][#Branch1][C][C][Ring1][P][C][Ring2][Ring1][O][=C][Ring2][Ring1][#C]", "smiles": "CCc1ccc2ncc(C#N)c(CCN3CCC(NCc4cc5c(cn4)OCS5)CC3)c2c1" }
6-ethyl-4-[2-[4-([1,3]oxathiolo[5,4-c]pyridin-6-ylmethylamino)piperidin-1-yl]ethyl]quinoline-3-carbonitrile
[ { "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-ethyl-4-[2-[4-([1,3]oxathiolo[5,4-c]pyridin-6-ylmethylamino)piperidin-1-yl]ethyl]quinoline-3-carbonitrile", "role": "assistant" } ]
299,281
{ "selfies": "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][=C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F]", "smiles": "CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)C(c1cc(Cl)ccc1C=O)C(F)(F)F" }
tert-butyl N-[1-(5-chloro-2-formylphenyl)-2,2,2-trifluoroethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
[ { "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 N-[1-(5-chloro-2-formylphenyl)-2,2,2-trifluoroethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate", "role": "assistant" } ]
299,284
{ "selfies": "[C][C][=C][C][Branch1][#Branch1][O][C][C][C][Ring1][Ring1][=C][N][=C][Ring1][#Branch2][F]", "smiles": "Cc1cc(OC2CC2)cnc1F" }
5-cyclopropyloxy-2-fluoro-3-methylpyridine
[ { "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-cyclopropyloxy-2-fluoro-3-methylpyridine", "role": "assistant" } ]
299,285
{ "selfies": "[C][N][C][=Branch1][C][=O][C][=N][C][=C][C][Branch1][Ring1][N][C][=C][Ring1][Branch2][O][C][C][C][Ring1][Ring1]", "smiles": "CNC(=O)c1nccc(NC)c1OC1CC1" }
3-cyclopropyloxy-N-methyl-4-(methylamino)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": "3-cyclopropyloxy-N-methyl-4-(methylamino)pyridine-2-carboxamide", "role": "assistant" } ]
299,286
{ "selfies": "[O][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][S][C][=N][C][=C][N][Ring1][#C][Ring1][Branch1]", "smiles": "O=c1cc(-c2ccccc2)sc2nccn12" }
7-phenylimidazo[2,1-b][1,3]thiazin-5-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": "7-phenylimidazo[2,1-b][1,3]thiazin-5-one", "role": "assistant" } ]
299,287
{ "selfies": "[C][C][C][C][C][=C][C][=C][C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][=C][C][=C][Ring1][#Branch2][O][Ring1][=N]", "smiles": "CCCCc1cc2cc(S(N)(=O)=O)ccc2o1" }
2-butyl-1-benzofuran-5-sulfonamide
[ { "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-butyl-1-benzofuran-5-sulfonamide", "role": "assistant" } ]
299,288
{ "selfies": "[C][C][O][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][=C][C][=C][C][=C][C][Branch1][=Branch1][B][Branch1][C][O][O][=C][Ring1][=Branch2]", "smiles": "CCOC(=O)C(C#N)=Cc1cccc(B(O)O)c1" }
[3-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]phenyl]boronic 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 denoted by <molecule_2d> .", "role": "user" }, { "content": "[3-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]phenyl]boronic acid", "role": "assistant" } ]
299,289
{ "selfies": "[C][C][Branch1][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][O][C][Ring1][N][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1]", "smiles": "CC1(C)C(c2ccccc2)=NOC1CC=Cc1ccccc1" }
4,4-dimethyl-3-phenyl-5-[(Z)-3-phenylprop-2-enyl]-5H-1,2-oxazole
[ { "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": "4,4-dimethyl-3-phenyl-5-[(Z)-3-phenylprop-2-enyl]-5H-1,2-oxazole", "role": "assistant" } ]
299,290
{ "selfies": "[C][C][=C][Branch2][Ring1][C][C][C][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][=Branch1][=O]", "smiles": "CC1=C(CCCCNC(=O)C(C)(C)C)C(=O)c2ccccc2C1=O" }
2,2-dimethyl-N-[4-(3-methyl-1,4-dioxonaphthalen-2-yl)butyl]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": "2,2-dimethyl-N-[4-(3-methyl-1,4-dioxonaphthalen-2-yl)butyl]propanamide", "role": "assistant" } ]
299,291
{ "selfies": "[C][C][O][C][=Branch1][C][=O][C][Branch1][=C][N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][O]", "smiles": "CCOC(=O)C(Nc1ccc(OC)cc1)c1ccc(O)cc1O" }
ethyl 2-(2,4-dihydroxyphenyl)-2-(4-methoxyanilino)acetate
[ { "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": "ethyl 2-(2,4-dihydroxyphenyl)-2-(4-methoxyanilino)acetate", "role": "assistant" } ]
299,292
{ "selfies": "[C][C][O][C][=Branch1][C][=O][C][=C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][=Branch2][C][=Branch1][C][=O][C][C][Ring1][=C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1]", "smiles": "CCOC(=O)C1=C2Oc3ccccc3N2C(=O)CC1c1ccc(Br)cc1" }
ethyl (3R)-3-(4-bromophenyl)-1-oxo-2,3-dihydropyrido[2,1-b][1,3]benzoxazole-4-carboxylate
[ { "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": "ethyl (3R)-3-(4-bromophenyl)-1-oxo-2,3-dihydropyrido[2,1-b][1,3]benzoxazole-4-carboxylate", "role": "assistant" } ]
299,293
{ "selfies": "[O][=C][C][C][=C][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][=C][C][=C][Ring1][O][N][Ring1][=C]", "smiles": "O=C1Cc2c(CC(F)(F)F)cccc2N1" }
4-(2,2,2-trifluoroethyl)-1,3-dihydroindol-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": "4-(2,2,2-trifluoroethyl)-1,3-dihydroindol-2-one", "role": "assistant" } ]
299,294
{ "selfies": "[C][O][C][=C][C][Branch1][C][Br][=C][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][C][C][Branch1][C][F][C][Ring1][Branch2][=O]", "smiles": "COc1cc(Br)c2c(c1)CCC(F)C2=O" }
8-bromo-2-fluoro-6-methoxy-3,4-dihydro-2H-naphthalen-1-one
[ { "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": "8-bromo-2-fluoro-6-methoxy-3,4-dihydro-2H-naphthalen-1-one", "role": "assistant" } ]
299,295
{ "selfies": "[C][N][C][=C][Branch2][Ring1][#C][C][=C][C][=N][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][Branch1][C][N][C][C][C][C][=N][NH1][C][=Ring1][Branch1][=C][Ring2][Ring1][C][C][=N][Ring2][Ring1][#Branch1]", "smiles": "Cn1cc(-c2ccnc(NC(=O)C(N)CCc3cn[nH]c3)c2)cn1" }
2-amino-N-[4-(1-methylpyrazol-4-yl)pyridin-2-yl]-4-(1H-pyrazol-4-yl)butanamide
[ { "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-amino-N-[4-(1-methylpyrazol-4-yl)pyridin-2-yl]-4-(1H-pyrazol-4-yl)butanamide", "role": "assistant" } ]
299,296
{ "selfies": "[C][S][C][=N][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][=N][Ring1][=N]", "smiles": "CSc1ncc(C(=O)O)c(CC(=O)O)n1" }
4-(carboxymethyl)-2-methylsulfanylpyrimidine-5-carboxylic acid
[ { "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": "4-(carboxymethyl)-2-methylsulfanylpyrimidine-5-carboxylic acid", "role": "assistant" } ]
299,297
{ "selfies": "[C][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Branch1][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=C][C][=C][Ring1][=N][Ring2][Ring1][Branch1]", "smiles": "CC1(C)c2ccccc2-c2c(-c3cccc(Cl)c3)cccc21" }
4-(3-chlorophenyl)-9,9-dimethylfluorene
[ { "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": "4-(3-chlorophenyl)-9,9-dimethylfluorene", "role": "assistant" } ]
299,298
{ "selfies": "[C][C][Branch1][C][C][C][=Branch2][=Branch2][Branch2][=C][C][=C][C][=C][C][=N+1][Branch2][#Branch1][Ring2][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][N][C][=C][Branch2][Branch1][N][C][C][N][C][C][N][Branch2][Ring2][=C][C][C][C][C][C][C][C][N][Branch2][Ring1][=C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][S][C][C][Ring2][Ring1][=Branch2][C][C][Ring2][Ring2][Ring1][N][=N][Ring2][Ring2][#Branch2][C][=C][C][=C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O-1][C][=C][Ring1][#Branch2][C][Ring2][=Branch1][C][Branch1][C][C][C][N][Branch1][N][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=C][C][=C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=C][Ring1][#Branch2][Ring2][#Branch1][=C]", "smiles": "CC1(C)C(=CC=CC=CC2=[N+](CCCCCC(=O)NCCCn3cc(CCN4CCN(CCCCC5CCN(CC(=O)N6c7ccccc7NC(=O)c7ccccc76)CC5)CC4)nn3)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)N(CCCS(=O)(=O)O)c2ccc(S(=O)(=O)O)cc21" }
2-[(1E,3E,5E)-5-[3,3-dimethyl-5-sulfo-1-(3-sulfopropyl)indol-2-ylidene]penta-1,3-dienyl]-3,3-dimethyl-1-[6-oxo-6-[3-[4-[2-[4-[4-[1-[2-oxo-2-(6-oxo-5H-benzo[b][1,4]benzodiazepin-11-yl)ethyl]piperidin-4-yl]butyl]piperazin-1-yl]ethyl]triazol-1-yl]propylamino]hexyl]indol-1-ium-5-sulfonate
[ { "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-[(1E,3E,5E)-5-[3,3-dimethyl-5-sulfo-1-(3-sulfopropyl)indol-2-ylidene]penta-1,3-dienyl]-3,3-dimethyl-1-[6-oxo-6-[3-[4-[2-[4-[4-[1-[2-oxo-2-(6-oxo-5H-benzo[b][1,4]benzodiazepin-11-yl)ethyl]piperidin-4-yl]butyl]piperazin-1-yl]ethyl]triazol-1-yl]propylamino]hexyl]indol-1-ium-5-sulfonate", "role": "assistant" } ]
299,299
{ "selfies": "[C][C][Branch2][Ring1][=C][C][=N][C][Branch1][=N][C][=Branch1][C][=O][N][C][C][=N][O][C][=Ring1][Branch1][=C][Branch1][C][O][C][=Branch1][C][=O][N][Ring1][S][C][C][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][#N]", "smiles": "CC(c1nc(C(=O)Nc2cnoc2)c(O)c(=O)n1C)C(c1cnn(C)c1)c1ccccc1C#N" }
2-[(1S,2R)-1-(2-cyanophenyl)-1-(1-methylpyrazol-4-yl)propan-2-yl]-5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxopyrimidine-4-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": "2-[(1S,2R)-1-(2-cyanophenyl)-1-(1-methylpyrazol-4-yl)propan-2-yl]-5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxopyrimidine-4-carboxamide", "role": "assistant" } ]
299,300
{ "selfies": "[C][O][C][=Branch1][C][=O][C][Branch1][C][N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O][C]", "smiles": "COC(=O)C(N)Cc1ccc(F)cc1OC" }
methyl (2S)-2-amino-3-(4-fluoro-2-methoxyphenyl)propanoate
[ { "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": "methyl (2S)-2-amino-3-(4-fluoro-2-methoxyphenyl)propanoate", "role": "assistant" } ]
299,301
{ "selfies": "[C][C][Branch1][C][C][O][B][Branch1][=N][C][=C][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][O][C][Ring1][=C][Branch1][C][C][C]", "smiles": "CC1(C)OB(C=CCCS(C)(=O)=O)OC1(C)C" }
4,4,5,5-tetramethyl-2-[(Z)-4-methylsulfonylbut-1-enyl]-1,3,2-dioxaborolane
[ { "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": "4,4,5,5-tetramethyl-2-[(Z)-4-methylsulfonylbut-1-enyl]-1,3,2-dioxaborolane", "role": "assistant" } ]
299,302
{ "selfies": "[O][=C][Branch1][=N][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][Cl]", "smiles": "O=C(Nc1ccc(F)cc1)C1Sc2ccccc2C1Cl" }
3-chloro-N-(4-fluorophenyl)-2,3-dihydro-1-benzothiophene-2-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": "3-chloro-N-(4-fluorophenyl)-2,3-dihydro-1-benzothiophene-2-carboxamide", "role": "assistant" } ]
299,303
{ "selfies": "[O][B][Branch1][C][O][C][=C][C][=C][Branch2][Ring1][#Branch1][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][Ring2]", "smiles": "OB(O)c1ccc(N(c2ccccc2)c2ccc(Br)cc2)cc1" }
[4-(N-(4-bromophenyl)anilino)phenyl]boronic 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": "[4-(N-(4-bromophenyl)anilino)phenyl]boronic acid", "role": "assistant" } ]
299,304
{ "selfies": "[C][C][O][C][=Branch1][C][=O][N][C][S][C][C][Ring1][Branch1][C][=Branch1][C][=O][N][C][N][=C][C][=C][C][Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][O][C][=C][N][Ring1][#C][N][=Ring2][Ring1][C]", "smiles": "CCOC(=O)N1CSCC1C(=O)Nc1nc2ccc(-c3ccccc3COC)cn2n1" }
ethyl (4S)-4-[[6-[2-(methoxymethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]carbamoyl]-1,3-thiazolidine-3-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": "ethyl (4S)-4-[[6-[2-(methoxymethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]carbamoyl]-1,3-thiazolidine-3-carboxylate", "role": "assistant" } ]
299,305
{ "selfies": "[C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][=C][N][=C][C][Branch2][Ring1][Ring2][B][O][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][=Branch2][=C][Ring1][#C]", "smiles": "CC(C)CC(=O)Nc1cncc(B2OC(C)(C)C(C)(C)O2)c1" }
3-methyl-N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]butanamide
[ { "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-methyl-N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]butanamide", "role": "assistant" } ]
299,306
{ "selfies": "[N][C][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Branch1][C][O][=C][Ring1][#Branch2][=C][Branch1][C][N][C][=C][Ring1][P][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Branch1][C][O][=C][Ring1][#Branch2]", "smiles": "Nc1cc(-c2ccc(C(=O)O)c(O)c2)c(N)cc1-c1ccc(C(=O)O)c(O)c1" }
4-[2,5-diamino-4-(4-carboxy-3-hydroxyphenyl)phenyl]-2-hydroxybenzoic 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 denoted by <molecule_2d> .", "role": "user" }, { "content": "4-[2,5-diamino-4-(4-carboxy-3-hydroxyphenyl)phenyl]-2-hydroxybenzoic acid", "role": "assistant" } ]
299,308
{ "selfies": "[C][O][C][=C][C][=C][Branch2][Branch1][Ring1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=N][C][Ring2][Ring1][#Branch1][C][=C][Ring2][Ring2][=Branch1][C][C][C][=Branch1][C][=O][O]", "smiles": "COc1ccc(-c2ccccc2NC(=O)C2CCCN(C(=O)OCC3c4ccccc4-c4ccccc43)C2)cc1CCC(=O)O" }
3-[5-[2-[[(3R)-1-(9H-fluoren-9-ylmethoxycarbonyl)piperidine-3-carbonyl]amino]phenyl]-2-methoxyphenyl]propanoic 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-[5-[2-[[(3R)-1-(9H-fluoren-9-ylmethoxycarbonyl)piperidine-3-carbonyl]amino]phenyl]-2-methoxyphenyl]propanoic acid", "role": "assistant" } ]
299,309
{ "selfies": "[C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=N][C][Branch1][#C][N][C][=Branch1][C][=O][C][S][Branch1][C][C][=Branch1][C][=O][=O][=N][N][Ring1][=N][C][=Ring1][P]", "smiles": "CSc1ccccc1-c1ccc2nc(NC(=O)CS(C)(=O)=O)nn2c1" }
N-[6-(2-methylsulfanylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-2-methylsulfonylacetamide
[ { "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-[6-(2-methylsulfanylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-2-methylsulfonylacetamide", "role": "assistant" } ]
299,310
{ "selfies": "[C][N][N][C][=C][C][C][C][C][Ring1][=Branch1][=C][C][Ring1][#Branch2][=O]", "smiles": "CN1NC2=CCCCC2=CC1=O" }
2-methyl-1,5,6,7-tetrahydrocinnolin-3-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-methyl-1,5,6,7-tetrahydrocinnolin-3-one", "role": "assistant" } ]
299,311
{ "selfies": "[N][C][=C][N][=C][C][Branch1][#C][C][=C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][=C][Ring1][=C]", "smiles": "Nc1cncc(C2=CCC(F)(F)CC2)c1" }
5-(4,4-difluorocyclohexen-1-yl)pyridin-3-amine
[ { "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-(4,4-difluorocyclohexen-1-yl)pyridin-3-amine", "role": "assistant" } ]
299,312
{ "selfies": "[C][O][C][C][C][C][Branch1][#Branch2][O][C][=C][C][=C][C][=N][Ring1][=Branch1][C][C][Ring1][=N][N][Branch1][=N][C][=Branch1][C][=O][C][N][C][=C][N][=C][Ring1][Branch1][C][C][Ring2][Ring1][Branch2]", "smiles": "COC12CCC(Oc3ccccn3)CC1N(C(=O)Cn1ccnc1)CC2" }
1-[(3aR)-3a-methoxy-6-pyridin-2-yloxy-3,4,5,6,7,7a-hexahydro-2H-indol-1-yl]-2-imidazol-1-ylethanone
[ { "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-[(3aR)-3a-methoxy-6-pyridin-2-yloxy-3,4,5,6,7,7a-hexahydro-2H-indol-1-yl]-2-imidazol-1-ylethanone", "role": "assistant" } ]
299,313
{ "selfies": "[C][C][Branch1][C][C][N][C][=N][C][=C][Branch2][Ring1][N][C][N][C][C][C][C][C][Branch1][Ring2][C][Ring1][#Branch1][N][Branch1][=Branch2][C][C][=C][S][C][=N][Ring1][Branch1][C][Ring1][=N][=O][C][=N][Ring2][Ring1][#Branch1]", "smiles": "CC(C)Nc1ncc(CN2CC3CCC(C2)N(Cc2cscn2)C3=O)cn1" }
3-[[2-(propan-2-ylamino)pyrimidin-5-yl]methyl]-6-(1,3-thiazol-4-ylmethyl)-3,6-diazabicyclo[3.2.2]nonan-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": "3-[[2-(propan-2-ylamino)pyrimidin-5-yl]methyl]-6-(1,3-thiazol-4-ylmethyl)-3,6-diazabicyclo[3.2.2]nonan-7-one", "role": "assistant" } ]
299,314
{ "selfies": "[C][O][C][=C][C][=C][NH1][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][Branch1][N][C][C][=C][C][Branch1][C][C][=N][O][Ring1][=Branch1][C][Ring1][=N][=C][C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][Branch2]", "smiles": "COc1ccc2[nH]c(C(=O)N3CC(O)C(Cc4cc(C)no4)C3)cc2c1" }
[3-hydroxy-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidin-1-yl]-(5-methoxy-1H-indol-2-yl)methanone
[ { "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-hydroxy-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidin-1-yl]-(5-methoxy-1H-indol-2-yl)methanone", "role": "assistant" } ]
299,315
{ "selfies": "[C][C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][Branch2][Ring2][Branch1][C][=N][C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][Branch1][#Branch2][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][Ring1][=N][=C][S][Ring2][Ring1][Ring2][N][=Ring2][Ring1][=N]", "smiles": "Cc1cc(C(F)(F)F)n(-c2nc(C(=O)N3CC(O)C(Cc4ccncc4)C3)cs2)n1" }
[3-hydroxy-4-(pyridin-4-ylmethyl)pyrrolidin-1-yl]-[2-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methanone
[ { "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-hydroxy-4-(pyridin-4-ylmethyl)pyrrolidin-1-yl]-[2-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methanone", "role": "assistant" } ]
299,316
{ "selfies": "[O][=C][Branch2][Ring1][=Branch1][N][C][=C][C][=C][Branch1][O][C][=C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=C][Ring1][=C][N][C][C][C][C][Branch1][#Branch1][C][C][N][C][Ring1][Branch1][C][Ring1][#Branch2]", "smiles": "O=C(Nc1ccc(C=Cc2ccccn2)cc1)N1CCCC2(CCNC2)C1" }
N-[4-(2-pyridin-2-ylethenyl)phenyl]-2,7-diazaspiro[4.5]decane-7-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": "N-[4-(2-pyridin-2-ylethenyl)phenyl]-2,7-diazaspiro[4.5]decane-7-carboxamide", "role": "assistant" } ]
299,317
{ "selfies": "[C][O][C][=C][C][=C][Branch2][Ring1][P][C][C][Branch1][#C][C][=Branch1][C][=O][N][C][C][=C][C][=C][N][=C][Ring1][=Branch1][O][C][C][=Branch1][C][=O][N][Ring1][P][C][C][C][Ring1][Ring1][C][=C][Ring2][Ring1][#Branch2]", "smiles": "COc1ccc(C2C(C(=O)NCc3cccnc3)OCC(=O)N2C2CC2)cc1" }
4-cyclopropyl-3-(4-methoxyphenyl)-5-oxo-N-(pyridin-3-ylmethyl)morpholine-2-carboxamide
[ { "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-cyclopropyl-3-(4-methoxyphenyl)-5-oxo-N-(pyridin-3-ylmethyl)morpholine-2-carboxamide", "role": "assistant" } ]
299,318
{ "selfies": "[C][C][Branch1][C][C][N][C][=C][C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C][O][C][C][=C][N][=N][N][Ring1][Branch1][C][Ring1][=Branch2][C][Ring1][=N][=N][Ring2][Ring1][Ring2]", "smiles": "CC(C)n1ccc(C(=O)N2CCC3OCc4cnnn4C3C2)n1" }
8-oxa-2,3,4,12-tetrazatricyclo[7.4.0.02,6]trideca-3,5-dien-12-yl-(1-propan-2-ylpyrazol-3-yl)methanone
[ { "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": "8-oxa-2,3,4,12-tetrazatricyclo[7.4.0.02,6]trideca-3,5-dien-12-yl-(1-propan-2-ylpyrazol-3-yl)methanone", "role": "assistant" } ]
299,319
{ "selfies": "[O][=C][Branch1][Branch2][C][C][C][=C][C][Ring1][Branch1][N][C][C][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Branch1][C][O][C][Ring1][P]", "smiles": "O=C(C1CC=CC1)N1CCC(Cc2ccccc2)(C(=O)O)C(O)C1" }
(4S)-4-benzyl-1-(cyclopent-3-ene-1-carbonyl)-3-hydroxypiperidine-4-carboxylic 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": "(4S)-4-benzyl-1-(cyclopent-3-ene-1-carbonyl)-3-hydroxypiperidine-4-carboxylic acid", "role": "assistant" } ]
299,320
{ "selfies": "[C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Branch1][C][O][C][Ring1][P]", "smiles": "Cc1ccccc1CCC(=O)N1CCC(Cc2ccccc2)(C(=O)O)C(O)C1" }
(4S)-4-benzyl-3-hydroxy-1-[3-(2-methylphenyl)propanoyl]piperidine-4-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": "(4S)-4-benzyl-3-hydroxy-1-[3-(2-methylphenyl)propanoyl]piperidine-4-carboxylic acid", "role": "assistant" } ]
299,321
{ "selfies": "[C][C][C][O][C][=C][C][=C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][Branch1][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][P][Cl]", "smiles": "CCCOc1ccc(NC(=O)C(N)c2ccccc2)cc1Cl" }
2-amino-N-(3-chloro-4-propoxyphenyl)-2-phenylacetamide
[ { "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-amino-N-(3-chloro-4-propoxyphenyl)-2-phenylacetamide", "role": "assistant" } ]
299,322
{ "selfies": "[C][C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][N][Branch2][Ring1][C][C][C][=C][C][Branch1][Ring1][O][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][C][C][Ring2][Ring1][Ring2][O]", "smiles": "CCCC1(C(=O)O)CCN(Cc2cc(OC)cc(OC)c2)CC1O" }
(4S)-1-[(3,5-dimethoxyphenyl)methyl]-3-hydroxy-4-propylpiperidine-4-carboxylic 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 denoted by <molecule_2d> .", "role": "user" }, { "content": "(4S)-1-[(3,5-dimethoxyphenyl)methyl]-3-hydroxy-4-propylpiperidine-4-carboxylic acid", "role": "assistant" } ]
299,323
{ "selfies": "[C][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][N][Branch1][#C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][C][Ring1][#C][O]", "smiles": "CN(C)S(=O)(=O)CC1CN(c2ccc3ccccc3n2)CC1O" }
1-(4-hydroxy-1-quinolin-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanesulfonamide
[ { "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-hydroxy-1-quinolin-2-ylpyrrolidin-3-yl)-N,N-dimethylmethanesulfonamide", "role": "assistant" } ]
299,324
{ "selfies": "[C][C][N][Branch1][#C][C][C][O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][C][C][N][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O]", "smiles": "CCN(CCOc1cccc(Cl)c1)C(=O)CCC1NC(=O)NC1=O" }
N-[2-(3-chlorophenoxy)ethyl]-3-(2,5-dioxoimidazolidin-4-yl)-N-ethylpropanamide
[ { "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-(3-chlorophenoxy)ethyl]-3-(2,5-dioxoimidazolidin-4-yl)-N-ethylpropanamide", "role": "assistant" } ]
299,325
{ "selfies": "[C][C][Branch1][C][C][C][C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][C][Ring1][#C][O][N][=Ring2][Ring1][Branch2]", "smiles": "CC(C)Cc1cc(C(=O)N2CC3CCC2CN(C(=O)c2ccncc2)C3)on1" }
[6-[3-(2-methylpropyl)-1,2-oxazole-5-carbonyl]-3,6-diazabicyclo[3.2.2]nonan-3-yl]-pyridin-4-ylmethanone
[ { "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": "[6-[3-(2-methylpropyl)-1,2-oxazole-5-carbonyl]-3,6-diazabicyclo[3.2.2]nonan-3-yl]-pyridin-4-ylmethanone", "role": "assistant" } ]
299,326
{ "selfies": "[C][O][C][C][C][N][C][=Branch1][C][=O][C][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][=C][C][=Branch1][C][=O][NH1][N][=Ring1][#Branch1][C][C][C][Ring1][#C][Ring2][Ring1][Ring2]", "smiles": "COCCCN1C(=O)CCC2CN(C(=O)c3ccc(=O)[nH]n3)CCC21" }
1-(3-methoxypropyl)-6-(6-oxo-1H-pyridazine-3-carbonyl)-4,4a,5,7,8,8a-hexahydro-3H-1,6-naphthyridin-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 represented by the following SMILES representation: <molecule_2d> .", "role": "user" }, { "content": "1-(3-methoxypropyl)-6-(6-oxo-1H-pyridazine-3-carbonyl)-4,4a,5,7,8,8a-hexahydro-3H-1,6-naphthyridin-2-one", "role": "assistant" } ]
299,327
{ "selfies": "[C][N][C][Branch1][O][N][C][C][C][Branch1][C][O][C][Ring1][=Branch1][=N][C][=C][C][Branch1][S][C][=Branch1][C][=O][N][C][C][C][N][C][=C][C][=N][Ring1][Branch1][=C][C][=C][Ring1][P][Ring2][Ring1][#Branch2]", "smiles": "Cn1c(N2CCC(O)C2)nc2cc(C(=O)NCCCn3cccn3)ccc21" }
2-(3-hydroxypyrrolidin-1-yl)-1-methyl-N-(3-pyrazol-1-ylpropyl)benzimidazole-5-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": "2-(3-hydroxypyrrolidin-1-yl)-1-methyl-N-(3-pyrazol-1-ylpropyl)benzimidazole-5-carboxamide", "role": "assistant" } ]
299,328
{ "selfies": "[C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][C][Branch1][Ring2][C][Ring1][#Branch1][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][Ring2][Ring1][Ring1]", "smiles": "CS(=O)(=O)N1CC2CCC(C1)N(C(=O)c1cccc(C(F)(F)F)c1)C2" }
(3-methylsulfonyl-3,6-diazabicyclo[3.2.2]nonan-6-yl)-[3-(trifluoromethyl)phenyl]methanone
[ { "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-methylsulfonyl-3,6-diazabicyclo[3.2.2]nonan-6-yl)-[3-(trifluoromethyl)phenyl]methanone", "role": "assistant" } ]
299,329
{ "selfies": "[C][C][Branch1][C][C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][C][Branch2][Ring1][Branch1][N][C][C][N][Branch1][O][C][=Branch1][C][=O][C][Branch1][C][N][C][O][C][C][Ring1][N][=N][Ring2][Ring1][=Branch1]", "smiles": "CC(C)c1cc(C(F)(F)F)nc(N2CCN(C(=O)C(N)CO)CC2)n1" }
2-amino-3-hydroxy-1-[4-[4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]piperazin-1-yl]propan-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": "2-amino-3-hydroxy-1-[4-[4-propan-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]piperazin-1-yl]propan-1-one", "role": "assistant" } ]
299,330
{ "selfies": "[O][=C][Branch1][O][C][C][C][C][=C][C][=C][S][Ring1][Branch1][N][C][C][N][Branch1][Ring2][C][C][O][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Ring1][#Branch1][Ring1][=C]", "smiles": "O=C(CCCc1cccs1)N1CCN(CCO)C2CS(=O)(=O)CC21" }
1-[1-(2-hydroxyethyl)-6,6-dioxo-2,3,4a,5,7,7a-hexahydrothieno[3,4-b]pyrazin-4-yl]-4-thiophen-2-ylbutan-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-[1-(2-hydroxyethyl)-6,6-dioxo-2,3,4a,5,7,7a-hexahydrothieno[3,4-b]pyrazin-4-yl]-4-thiophen-2-ylbutan-1-one", "role": "assistant" } ]