id
int64 0
300k
| molecules
dict | ground_truth
stringlengths 7
2.47k
| messages
listlengths 3
3
|
---|---|---|---|
297,860 | {
"selfies": "[C][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][=N][C][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][=N][N][Ring1][#Branch2][C][C][C][C][C][Ring1][Branch1][C][=C][Ring2][Ring1][Branch1]",
"smiles": "COc1ccc(-c2nc(-c3ccsc3)nn2C2CCCC2)cc1"
} | 1-cyclopentyl-5-(4-methoxyphenyl)-3-thiophen-3-yl-1,2,4-triazole | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .",
"role": "user"
},
{
"content": "1-cyclopentyl-5-(4-methoxyphenyl)-3-thiophen-3-yl-1,2,4-triazole",
"role": "assistant"
}
] |
297,861 | {
"selfies": "[O][=S][=Branch1][C][=O][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1]",
"smiles": "O=S(=O)(Nc1ccccc1)c1ccccc1NS(=O)(=O)c1cccc2ccccc12"
} | N-[2-(phenylsulfamoyl)phenyl]naphthalene-1-sulfonamide | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.",
"role": "user"
},
{
"content": "N-[2-(phenylsulfamoyl)phenyl]naphthalene-1-sulfonamide",
"role": "assistant"
}
] |
297,862 | {
"selfies": "[C][N][Branch1][#C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch2][C][=C][C][O][C][C][Ring1][=Branch1][=C][Ring1][N]",
"smiles": "CN(CC(=O)NC(C)(C)C)C(=O)c1cccc(C2=CCOCC2)c1"
} | N-[2-(tert-butylamino)-2-oxoethyl]-3-(3,6-dihydro-2H-pyran-4-yl)-N-methylbenzamide | [
{
"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-[2-(tert-butylamino)-2-oxoethyl]-3-(3,6-dihydro-2H-pyran-4-yl)-N-methylbenzamide",
"role": "assistant"
}
] |
297,863 | {
"selfies": "[C][C][=N][N][=C][Branch2][Ring1][C][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][=N][C][=C][S][Ring1][Branch1][N][Ring1][S][C]",
"smiles": "Cc1nnc(N(C)CC(=O)Nc2nccs2)n1C"
} | 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)-methylamino]-N-(1,3-thiazol-2-yl)acetamide | [
{
"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-[(4,5-dimethyl-1,2,4-triazol-3-yl)-methylamino]-N-(1,3-thiazol-2-yl)acetamide",
"role": "assistant"
}
] |
297,865 | {
"selfies": "[C][N][Branch1][C][C][C][C][C][N][Branch2][Ring2][C][C][=C][C][=C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][Ring1][#Branch2][N][=C][Ring2][Ring1][Ring1][C][Ring2][Ring1][Branch2]",
"smiles": "CN(C)C1CCN(c2ccc(NC(=O)C3COc4ccc(Br)cc43)nc2)C1"
} | 5-bromo-N-[5-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-2-yl]-2,3-dihydro-1-benzofuran-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": "5-bromo-N-[5-[3-(dimethylamino)pyrrolidin-1-yl]pyridin-2-yl]-2,3-dihydro-1-benzofuran-3-carboxamide",
"role": "assistant"
}
] |
297,866 | {
"selfies": "[C][C][C][=C][Branch1][C][C][N][N][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][N][C][C][O][C][C][C][S][C][Branch1][C][F][=C][C][=Ring1][=Branch1][Ring1][#Branch2][N][=C][Ring2][Ring1][Ring2][N][=Ring2][Ring1][=Branch2]",
"smiles": "Cc1cc(C)n2nc(NC(=O)NCC3OCCc4sc(F)cc43)nc2n1"
} | 1-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3-[(2-fluoro-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)methyl]urea | [
{
"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-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3-[(2-fluoro-6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)methyl]urea",
"role": "assistant"
}
] |
297,867 | {
"selfies": "[O][=C][C][C][C][Branch2][Ring1][#Branch1][C][=C][C][=C][C][Branch1][=N][N][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][S][N][Ring2][Ring1][Branch1]",
"smiles": "O=C1CCC(c2cccc(NCCOc3ccccc3)c2)N1"
} | 5-[3-(2-phenoxyethylamino)phenyl]pyrrolidin-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 for the molecule whose SMILES representation is <molecule_2d> ?",
"role": "user"
},
{
"content": "5-[3-(2-phenoxyethylamino)phenyl]pyrrolidin-2-one",
"role": "assistant"
}
] |
297,868 | {
"selfies": "[C][N][C][=C][Branch2][Ring2][O][C][C][N][Branch2][Ring1][N][C][=Branch1][C][=O][C][Branch1][P][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring1][=N][C][C][Ring2][Ring1][Ring2][Branch1][C][C][C][C][=N][Ring2][Ring1][O]",
"smiles": "Cn1cc(C2CN(C(=O)C3(C(=O)Nc4ccc(F)cc4)CC3)CC2(C)C)cn1"
} | 1-[3,3-dimethyl-4-(1-methylpyrazol-4-yl)pyrrolidine-1-carbonyl]-N-(4-fluorophenyl)cyclopropane-1-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": "1-[3,3-dimethyl-4-(1-methylpyrazol-4-yl)pyrrolidine-1-carbonyl]-N-(4-fluorophenyl)cyclopropane-1-carboxamide",
"role": "assistant"
}
] |
297,869 | {
"selfies": "[C][C][=C][S][C][Branch2][Ring2][Branch1][S][C][=C][C][=C][Branch2][Ring1][Branch2][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][N][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][C][=C][Ring2][Ring1][Ring1][=N][Ring2][Ring1][=Branch2]",
"smiles": "Cc1csc(Sc2ccc(NS(=O)(=O)c3cn(C)c(=O)[nH]c3=O)cc2)n1"
} | 1-methyl-N-[4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]-2,4-dioxopyrimidine-5-sulfonamide | [
{
"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-methyl-N-[4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]-2,4-dioxopyrimidine-5-sulfonamide",
"role": "assistant"
}
] |
297,870 | {
"selfies": "[O][=C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][N][C][C][C][Branch2][Ring1][Ring1][N][C][=C][C][=N][C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][=N][Ring1][O][C][C][Ring2][Ring1][C]",
"smiles": "O=C(c1ccccc1O)N1CCC(Nc2ccnc(N3CCCC3)n2)CC1"
} | (2-hydroxyphenyl)-[4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)amino]piperidin-1-yl]methanone | [
{
"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-hydroxyphenyl)-[4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)amino]piperidin-1-yl]methanone",
"role": "assistant"
}
] |
297,871 | {
"selfies": "[N][#C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][N][C][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][=N]",
"smiles": "N#Cc1c(Cl)cccc1N1CCC(C(F)(F)F)(C(F)(F)F)C1"
} | 2-[3,3-bis(trifluoromethyl)pyrrolidin-1-yl]-6-chlorobenzonitrile | [
{
"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-[3,3-bis(trifluoromethyl)pyrrolidin-1-yl]-6-chlorobenzonitrile",
"role": "assistant"
}
] |
297,872 | {
"selfies": "[O][=C][Branch1][#C][C][=C][C][=C][C][=C][N][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][N][C][C][C][C][Branch2][Ring1][C][N][C][C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][C][Ring1][#Branch2][=O][C][Ring1][P]",
"smiles": "O=C(c1ccc2ccncc2c1)N1CCCC(N2CCN(CC3CC3)CC2=O)C1"
} | 4-(cyclopropylmethyl)-1-[1-(isoquinoline-7-carbonyl)piperidin-3-yl]piperazin-2-one | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.",
"role": "user"
},
{
"content": "4-(cyclopropylmethyl)-1-[1-(isoquinoline-7-carbonyl)piperidin-3-yl]piperazin-2-one",
"role": "assistant"
}
] |
297,873 | {
"selfies": "[O][=C][Branch1][C][O][C][=C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][N][Branch1][#C][C][=C][N][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][C][Ring1][S][C][=C][Ring2][Ring1][Branch2]",
"smiles": "O=C(O)c1ccc(C(=O)N2CCN(c3cncc4ccccc34)CC2)cc1"
} | 4-(4-isoquinolin-4-ylpiperazine-1-carbonyl)benzoic 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-(4-isoquinolin-4-ylpiperazine-1-carbonyl)benzoic acid",
"role": "assistant"
}
] |
297,874 | {
"selfies": "[C][N][C][=C][Branch2][Ring1][#Branch2][C][=N][C][Branch1][P][C][=N][N][=C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][O][Ring1][#Branch2][=C][O][Ring1][#C][C][=N][Ring2][Ring1][Ring2]",
"smiles": "Cn1cc(-c2nc(-c3nnc(C4CCCC4)o3)co2)cn1"
} | 2-cyclopentyl-5-[2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-1,3,4-oxadiazole | [
{
"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-cyclopentyl-5-[2-(1-methylpyrazol-4-yl)-1,3-oxazol-4-yl]-1,3,4-oxadiazole",
"role": "assistant"
}
] |
297,875 | {
"selfies": "[O][=C][Branch2][Ring1][N][N][C][Branch1][P][C][=C][C][=C][Branch1][#Branch1][O][C][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][C][C][O][C][Ring1][S][C][=C][N][=C][Branch1][O][C][=N][O][C][=Branch1][C][=O][NH1][Ring1][=Branch1][C][=N][Ring1][N]",
"smiles": "O=C(NC1(c2ccc(OC(F)F)cc2)CCCOC1)c1cnc(-c2noc(=O)[nH]2)cn1"
} | N-[3-[4-(difluoromethoxy)phenyl]oxan-3-yl]-5-(5-oxo-4H-1,2,4-oxadiazol-3-yl)pyrazine-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": "N-[3-[4-(difluoromethoxy)phenyl]oxan-3-yl]-5-(5-oxo-4H-1,2,4-oxadiazol-3-yl)pyrazine-2-carboxamide",
"role": "assistant"
}
] |
297,876 | {
"selfies": "[C][S][C][=C][C][Branch2][Ring1][N][C][=N][C][Branch1][#Branch2][C][S][Branch1][C][C][=Branch1][C][=O][=O][=N][N][Ring1][#Branch2][C][Branch1][C][C][C][C][C][Ring1][Ring1][=C][C][=N][Ring2][Ring1][Branch1]",
"smiles": "CSc1cc(-c2nc(CS(C)(=O)=O)nn2C(C)C2CC2)ccn1"
} | 4-[2-(1-cyclopropylethyl)-5-(methylsulfonylmethyl)-1,2,4-triazol-3-yl]-2-methylsulfanylpyridine | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?",
"role": "user"
},
{
"content": "4-[2-(1-cyclopropylethyl)-5-(methylsulfonylmethyl)-1,2,4-triazol-3-yl]-2-methylsulfanylpyridine",
"role": "assistant"
}
] |
297,877 | {
"selfies": "[C][O][C][=Branch1][C][=O][C][=C][C][Branch2][Ring1][C][C][N][Branch1][C][C][C][C][=C][C][=C][C][=Branch1][C][=O][NH1][Ring1][#Branch1][=C][C][=C][Ring1][P][C]",
"smiles": "COC(=O)c1cc(CN(C)Cc2cccc(=O)[nH]2)ccc1C"
} | methyl 2-methyl-5-[[methyl-[(6-oxo-1H-pyridin-2-yl)methyl]amino]methyl]benzoate | [
{
"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 2-methyl-5-[[methyl-[(6-oxo-1H-pyridin-2-yl)methyl]amino]methyl]benzoate",
"role": "assistant"
}
] |
297,879 | {
"selfies": "[O][=S][=Branch1][C][=O][Branch1][O][C][C][C][C][C][C][C][C][Ring1][=Branch1][C][C][=N][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][O][C][C][Ring1][#Branch1]",
"smiles": "O=S(=O)(CCC1CCCCC1)Cc1nc2c(s1)COCC2"
} | 2-(2-cyclohexylethylsulfonylmethyl)-6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazole | [
{
"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-cyclohexylethylsulfonylmethyl)-6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazole",
"role": "assistant"
}
] |
297,880 | {
"selfies": "[N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][Ring1][Branch1][C][Ring1][#C]",
"smiles": "NC(=O)N1CCCC1C(=O)NC1CC(NC(=O)c2ccc3c(c2)CC3)C1"
} | (2S)-2-N-[3-(bicyclo[4.2.0]octa-1(6),2,4-triene-3-carbonylamino)cyclobutyl]pyrrolidine-1,2-dicarboxamide | [
{
"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)-2-N-[3-(bicyclo[4.2.0]octa-1(6),2,4-triene-3-carbonylamino)cyclobutyl]pyrrolidine-1,2-dicarboxamide",
"role": "assistant"
}
] |
297,881 | {
"selfies": "[C][C][C][C][C][N][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][=N][O][C][Ring1][O][=O]",
"smiles": "CCCCCn1c(-c2ccncc2)noc1=O"
} | 4-pentyl-3-pyridin-4-yl-1,2,4-oxadiazol-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 represented by the following SMILES representation: <molecule_2d> .",
"role": "user"
},
{
"content": "4-pentyl-3-pyridin-4-yl-1,2,4-oxadiazol-5-one",
"role": "assistant"
}
] |
297,882 | {
"selfies": "[C][C][O][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=Ring1][O][C][=Branch1][C][=O][N][C][C][=C][Branch1][=C][C][=C][NH1][C][=N][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][C][Ring1][#C]",
"smiles": "Cc1onc(-c2ccccn2)c1C(=O)N1CC=C(c2c[nH]c3ncccc23)CC1"
} | (5-methyl-3-pyridin-2-yl-1,2-oxazol-4-yl)-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone | [
{
"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-methyl-3-pyridin-2-yl-1,2-oxazol-4-yl)-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridin-1-yl]methanone",
"role": "assistant"
}
] |
297,883 | {
"selfies": "[O][=C][Branch2][Ring1][Ring1][C][C][Branch1][Branch2][C][N][=N][NH1][N][=Ring1][Branch1][C][C][C][C][C][Ring1][O][N][C][C][C][C][=Branch1][=Branch1][=C][Branch1][C][F][F][C][C][Ring1][=Branch2]",
"smiles": "O=C(CC1(c2nn[nH]n2)CCCCC1)NC1CCC(=C(F)F)CC1"
} | N-[4-(difluoromethylidene)cyclohexyl]-2-[1-(2H-tetrazol-5-yl)cyclohexyl]acetamide | [
{
"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-[4-(difluoromethylidene)cyclohexyl]-2-[1-(2H-tetrazol-5-yl)cyclohexyl]acetamide",
"role": "assistant"
}
] |
297,884 | {
"selfies": "[C][C][=C][Branch1][#C][C][Branch1][C][C][N][C][C][=N][C][=C][N][Ring1][Branch1][C][N][=N][N][Ring1][#C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]",
"smiles": "Cc1c(C(C)NCc2nccn2C)nnn1-c1ccc(Cl)cc1"
} | 1-[1-(4-chlorophenyl)-5-methyltriazol-4-yl]-N-[(1-methylimidazol-2-yl)methyl]ethanamine | [
{
"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-[1-(4-chlorophenyl)-5-methyltriazol-4-yl]-N-[(1-methylimidazol-2-yl)methyl]ethanamine",
"role": "assistant"
}
] |
297,885 | {
"selfies": "[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring2][Ring1][#Branch2]",
"smiles": "COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)c2cccc(C(=O)O)c2)c1"
} | 3-[(5-methoxycarbonyl-2-phenylmethoxyphenyl)carbamoyl]benzoic acid | [
{
"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-[(5-methoxycarbonyl-2-phenylmethoxyphenyl)carbamoyl]benzoic acid",
"role": "assistant"
}
] |
297,886 | {
"selfies": "[C][O][C][=C][C][=C][NH1][N][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][N][C][C][C][C][C][Ring1][=Branch1][=O][C][C][C][Ring1][S][C][Ring2][Ring1][Ring2][C][Ring2][Ring1][N][=C][Ring2][Ring1][S]",
"smiles": "COc1ccc2[nH]nc(C(=O)NC3CCC4CN(C(=O)CN5CCCCC5=O)CCC4C3)c2c1"
} | 5-methoxy-N-[2-[2-(2-oxopiperidin-1-yl)acetyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-6-yl]-1H-indazole-3-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": "5-methoxy-N-[2-[2-(2-oxopiperidin-1-yl)acetyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-6-yl]-1H-indazole-3-carboxamide",
"role": "assistant"
}
] |
297,887 | {
"selfies": "[C][C][Branch1][C][C][C][C][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C][C][=C][S][C][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][=N][Ring1][=C][C][C][Branch1][C][C][Branch1][C][C][N][Ring2][Ring1][O]",
"smiles": "CC1(C)CC(NC(=O)Cc2csc(-c3ccc4c(c3)OCO4)n2)CC(C)(C)N1"
} | 2-[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Can you give the IUPAC name of the molecule <molecule_2d> ?",
"role": "user"
},
{
"content": "2-[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide",
"role": "assistant"
}
] |
297,888 | {
"selfies": "[C][O][C][Branch2][Ring1][C][C][C][C][=C][N][Branch1][Branch2][C][C][=C][Branch1][C][C][C][N][=Ring1][#Branch2][O][C]",
"smiles": "COC(Cc1ccn(CC=C(C)C)n1)OC"
} | 3-(2,2-dimethoxyethyl)-1-(3-methylbut-2-enyl)pyrazole | [
{
"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-(2,2-dimethoxyethyl)-1-(3-methylbut-2-enyl)pyrazole",
"role": "assistant"
}
] |
297,889 | {
"selfies": "[C][N][C][Branch2][Ring1][=Branch1][C][C][C][N][C][=C][C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][=C][N][=N][Ring1][O][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][Branch2]",
"smiles": "Cn1c(CCCNc2cc(N3CCCC3)cnn2)nc2ccccc21"
} | N-[3-(1-methylbenzimidazol-2-yl)propyl]-5-pyrrolidin-1-ylpyridazin-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": "N-[3-(1-methylbenzimidazol-2-yl)propyl]-5-pyrrolidin-1-ylpyridazin-3-amine",
"role": "assistant"
}
] |
297,890 | {
"selfies": "[C][C][O][C][=Branch1][C][=O][C][=C][N][C][=C][N][=C][Branch2][Ring1][C][N][C][C][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring1][#Branch2][C][Ring1][P][=N][Ring2][Ring1][Ring2]",
"smiles": "CCOC(=O)c1cn2ccnc(NC3CCc4ccc(F)cc43)c2n1"
} | ethyl 8-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]imidazo[1,2-a]pyrazine-2-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 8-[(6-fluoro-2,3-dihydro-1H-inden-1-yl)amino]imidazo[1,2-a]pyrazine-2-carboxylate",
"role": "assistant"
}
] |
297,891 | {
"selfies": "[C][C][=N][O][C][=N][C][=N][C][Branch2][Ring1][#Branch2][N][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][=C][Ring2][Ring1][Branch2][Ring2][Ring1][Branch1]",
"smiles": "Cc1noc2ncnc(N(CCC(=O)O)Cc3ccc(F)c(F)c3)c12"
} | 3-[(3,4-difluorophenyl)methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]propanoic acid | [
{
"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-[(3,4-difluorophenyl)methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]propanoic acid",
"role": "assistant"
}
] |
297,892 | {
"selfies": "[O][=S][=Branch1][C][=O][Branch2][Ring1][Branch2][N][C][=C][Branch1][C][F][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][F][C][=C][NH1][C][=N][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch2][Ring1][#Branch1]",
"smiles": "O=S(=O)(Nc1c(F)cc(C(F)(F)F)cc1F)c1c[nH]c2ncc(Cl)cc12"
} | 5-chloro-N-[2,6-difluoro-4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-3-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": "5-chloro-N-[2,6-difluoro-4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-3-sulfonamide",
"role": "assistant"
}
] |
297,894 | {
"selfies": "[O][=C][Branch1][C][O][C][C][C][C][C][=C][C][Branch1][S][C][=C][N][=C][C][Branch1][=Branch1][C][Branch1][C][F][F][=C][Ring1][=Branch2][=C][C][=C][Ring1][#C][Ring2][Ring1][C]",
"smiles": "O=C(O)CC1CCc2cc(-c3cncc(C(F)F)c3)ccc21"
} | 2-[5-[5-(difluoromethyl)pyridin-3-yl]-2,3-dihydro-1H-inden-1-yl]acetic 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-[5-[5-(difluoromethyl)pyridin-3-yl]-2,3-dihydro-1H-inden-1-yl]acetic acid",
"role": "assistant"
}
] |
297,895 | {
"selfies": "[O][=C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][=N][N][Branch1][#Branch1][C][C][N][C][Ring1][Ring2][N][=Ring1][=Branch2]",
"smiles": "O=C(CCc1ccccc1)Nc1cnn(C2CNC2)n1"
} | N-[2-(azetidin-3-yl)triazol-4-yl]-3-phenylpropanamide | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Provide the IUPAC name for the molecule represented as <molecule_2d> .",
"role": "user"
},
{
"content": "N-[2-(azetidin-3-yl)triazol-4-yl]-3-phenylpropanamide",
"role": "assistant"
}
] |
297,896 | {
"selfies": "[C][=C][C][C][C][=N][N][Branch1][=C][C][C][=C][N][Branch1][Branch1][C][C][O][C][N][=Ring1][=Branch2][C][=Branch1][C][=O][C][Ring1][#C]",
"smiles": "C=CCCC1=NN(c2ccn(CCOC)n2)C(=O)C1"
} | 5-but-3-enyl-2-[1-(2-methoxyethyl)pyrazol-3-yl]-4H-pyrazol-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 for the molecule whose SMILES representation is <molecule_2d> ?",
"role": "user"
},
{
"content": "5-but-3-enyl-2-[1-(2-methoxyethyl)pyrazol-3-yl]-4H-pyrazol-3-one",
"role": "assistant"
}
] |
297,897 | {
"selfies": "[C][#C][C][C][C][Branch2][Ring1][Branch2][C][C][N][C][Branch1][Branch2][C][=N][C][=C][NH1][Ring1][Branch1][C][=N][N][=N][N][Ring1][Branch1][C][C][C][N][=N][Ring2][Ring1][Ring2]",
"smiles": "C#CCCC1(CCNC(c2ncc[nH]2)c2nnnn2CCC)N=N1"
} | 2-(3-but-3-ynyldiazirin-3-yl)-N-[1H-imidazol-2-yl-(1-propyltetrazol-5-yl)methyl]ethanamine | [
{
"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-(3-but-3-ynyldiazirin-3-yl)-N-[1H-imidazol-2-yl-(1-propyltetrazol-5-yl)methyl]ethanamine",
"role": "assistant"
}
] |
297,899 | {
"selfies": "[C][C][Branch1][C][C][Branch1][C][C][C][Branch2][Ring1][=C][N][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][=C][C][C][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][#C][C][=C][C][=C][S][Ring1][Branch1]",
"smiles": "CC(C)(C)C(NC(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1)c1cccs1"
} | 1-(2,2-dimethyl-1-thiophen-2-ylpropyl)-3-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]urea | [
{
"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-(2,2-dimethyl-1-thiophen-2-ylpropyl)-3-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]urea",
"role": "assistant"
}
] |
297,900 | {
"selfies": "[O][=C][Branch1][P][C][C][N][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][C][Ring1][#Branch2][N][C][C][C][C][Ring1][Branch1][C][C][=C][C][=Branch1][C][=O][NH1][N][=Ring1][#Branch1]",
"smiles": "O=C(C1CN(C2CCCCC2)C1)N1CCCC1c1ccc(=O)[nH]n1"
} | 3-[1-(1-cyclohexylazetidine-3-carbonyl)pyrrolidin-2-yl]-1H-pyridazin-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": "3-[1-(1-cyclohexylazetidine-3-carbonyl)pyrrolidin-2-yl]-1H-pyridazin-6-one",
"role": "assistant"
}
] |
297,901 | {
"selfies": "[C][C][O][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][N][C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][C][=C][N][Branch1][O][C][C][C][=C][C][=C][C][=N][Ring1][=Branch1][N][=N][Ring1][=N]",
"smiles": "CCOC(=O)NCCC(=O)NC(CC(=O)O)Cc1cn(CCc2ccccn2)nn1"
} | 3-[3-(ethoxycarbonylamino)propanoylamino]-4-[1-(2-pyridin-2-ylethyl)triazol-4-yl]butanoic 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": "3-[3-(ethoxycarbonylamino)propanoylamino]-4-[1-(2-pyridin-2-ylethyl)triazol-4-yl]butanoic acid",
"role": "assistant"
}
] |
297,902 | {
"selfies": "[C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][Branch1][C][N][=C][Branch1][C][C][S][Ring1][#Branch1]",
"smiles": "CNS(=O)(=O)CCN(C)S(=O)(=O)c1cc(N)c(C)s1"
} | 4-amino-N,5-dimethyl-N-[2-(methylsulfamoyl)ethyl]thiophene-2-sulfonamide | [
{
"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-amino-N,5-dimethyl-N-[2-(methylsulfamoyl)ethyl]thiophene-2-sulfonamide",
"role": "assistant"
}
] |
297,903 | {
"selfies": "[C][C][Branch1][=C][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][N][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][N][C][=N][Ring1][#Branch1]",
"smiles": "CC(Cc1ccc(Cl)cc1Cl)NC(=O)c1cnc(N)cn1"
} | 5-amino-N-[1-(2,4-dichlorophenyl)propan-2-yl]pyrazine-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": "5-amino-N-[1-(2,4-dichlorophenyl)propan-2-yl]pyrazine-2-carboxamide",
"role": "assistant"
}
] |
297,904 | {
"selfies": "[C][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1][C][Ring2][Ring1][C]",
"smiles": "CN(C)S(=O)(=O)N1CC(NC(=O)Nc2ccc3c(n2)OCCO3)C1"
} | 1-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-3-[1-(dimethylsulfamoyl)azetidin-3-yl]urea | [
{
"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-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-3-[1-(dimethylsulfamoyl)azetidin-3-yl]urea",
"role": "assistant"
}
] |
297,905 | {
"selfies": "[C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][N][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][=C][Ring2][Ring1][Ring1][C][Ring2][Ring1][=Branch1]",
"smiles": "CC1CC1C(=O)N1Cc2ccc(CNC(=O)CN3CCC(=O)NC3=O)cc2C1"
} | 2-(2,4-dioxo-1,3-diazinan-1-yl)-N-[[2-(2-methylcyclopropanecarbonyl)-1,3-dihydroisoindol-5-yl]methyl]acetamide | [
{
"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-(2,4-dioxo-1,3-diazinan-1-yl)-N-[[2-(2-methylcyclopropanecarbonyl)-1,3-dihydroisoindol-5-yl]methyl]acetamide",
"role": "assistant"
}
] |
297,906 | {
"selfies": "[C][C][C][=C][C][=C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O][=C][Ring1][P][O]",
"smiles": "CCc1cccc(NC(=O)CC2NC(=O)NC2=O)c1O"
} | 2-[(4S)-2,5-dioxoimidazolidin-4-yl]-N-(3-ethyl-2-hydroxyphenyl)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": "2-[(4S)-2,5-dioxoimidazolidin-4-yl]-N-(3-ethyl-2-hydroxyphenyl)acetamide",
"role": "assistant"
}
] |
297,907 | {
"selfies": "[O][=C][Branch1][S][N][C][Branch1][Ring1][C][F][Branch1][Ring1][C][F][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][C][Br][O][Ring1][=Branch1]",
"smiles": "O=C(NC(CF)(CF)C(=O)O)c1ccc(Br)o1"
} | 2-[(5-bromofuran-2-carbonyl)amino]-3-fluoro-2-(fluoromethyl)propanoic acid | [
{
"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-[(5-bromofuran-2-carbonyl)amino]-3-fluoro-2-(fluoromethyl)propanoic acid",
"role": "assistant"
}
] |
297,908 | {
"selfies": "[O][=C][Branch2][Ring1][S][N][C][=C][C][=C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][C][C][C][Branch1][C][O][C][N][Ring1][=Branch1][C][Ring1][#Branch2][=O][C][=C][Ring1][P][C][=C][C][=C][O][Ring1][Branch1]",
"smiles": "O=C(Nc1ccc(N2C(=O)C3CC(O)CN3C2=O)cc1)c1ccco1"
} | N-[4-[(6R,7aS)-6-hydroxy-1,3-dioxo-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazol-2-yl]phenyl]furan-2-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": "N-[4-[(6R,7aS)-6-hydroxy-1,3-dioxo-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazol-2-yl]phenyl]furan-2-carboxamide",
"role": "assistant"
}
] |
297,909 | {
"selfies": "[C][O][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][C][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C]",
"smiles": "COCCS(=O)(=O)N(C)CC(=O)Nc1ccc(Cl)cc1C"
} | N-(4-chloro-2-methylphenyl)-2-[2-methoxyethylsulfonyl(methyl)amino]acetamide | [
{
"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-(4-chloro-2-methylphenyl)-2-[2-methoxyethylsulfonyl(methyl)amino]acetamide",
"role": "assistant"
}
] |
297,910 | {
"selfies": "[C][#C][C][C][C][Branch2][Ring1][#Branch2][C][C][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][=Branch1][C][=O][O][N][=N][Ring2][Ring1][Ring2]",
"smiles": "C#CCCC1(CCC(=O)N2CCc3ccccc3C2C(=O)O)N=N1"
} | 2-[3-(3-but-3-ynyldiazirin-3-yl)propanoyl]-3,4-dihydro-1H-isoquinoline-1-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": "2-[3-(3-but-3-ynyldiazirin-3-yl)propanoyl]-3,4-dihydro-1H-isoquinoline-1-carboxylic acid",
"role": "assistant"
}
] |
297,911 | {
"selfies": "[C][C][Branch1][C][C][C][Branch1][C][F][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch2][N][C][C][Branch1][C][N][=O][C][=C][Ring1][O][C][C][Ring2][Ring1][Ring1][C]",
"smiles": "CC(C)C(F)C(=O)N1CCN(C(=O)c2ccc(NCC(N)=O)cc2)CC1C"
} | 2-[4-[(3R)-4-(2-fluoro-3-methylbutanoyl)-3-methylpiperazine-1-carbonyl]anilino]acetamide | [
{
"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-[4-[(3R)-4-(2-fluoro-3-methylbutanoyl)-3-methylpiperazine-1-carbonyl]anilino]acetamide",
"role": "assistant"
}
] |
297,912 | {
"selfies": "[C][C][C][=C][C][=Branch1][C][=O][N][NH1][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=C][N][C][=C][S][C][Ring1][Branch1][=N][Ring1][Branch2][=N][C][Ring1][P][=N][Ring2][Ring1][=Branch1]",
"smiles": "CCc1cc(=O)n2[nH]c(NC(=O)Cc3cn4ccsc4n3)nc2n1"
} | N-(5-ethyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide | [
{
"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-(5-ethyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide",
"role": "assistant"
}
] |
297,913 | {
"selfies": "[C][C][O][C][C][C][Branch1][P][N][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Ring1][#Branch1][O][C][C][Ring1][=C][C][C][C][Ring1][Ring2]",
"smiles": "CCOC1CC(NC2CS(=O)(=O)CC2OC)C12CCC2"
} | (3S,4R)-N-(3-ethoxyspiro[3.3]heptan-1-yl)-4-methoxy-1,1-dioxothiolan-3-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": "(3S,4R)-N-(3-ethoxyspiro[3.3]heptan-1-yl)-4-methoxy-1,1-dioxothiolan-3-amine",
"role": "assistant"
}
] |
297,914 | {
"selfies": "[C][O][C][=C][C][=C][Branch2][Ring1][#C][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][N][=N][NH1][N][=Ring1][Branch1][C][C][Ring1][P][N][=C][Ring2][Ring1][#Branch1]",
"smiles": "COc1ccc(C2CCN(C(=O)CC(C)(C)c3nn[nH]n3)CC2)nc1"
} | 1-[4-(5-methoxypyridin-2-yl)piperidin-1-yl]-3-methyl-3-(2H-tetrazol-5-yl)butan-1-one | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.",
"role": "user"
},
{
"content": "1-[4-(5-methoxypyridin-2-yl)piperidin-1-yl]-3-methyl-3-(2H-tetrazol-5-yl)butan-1-one",
"role": "assistant"
}
] |
297,915 | {
"selfies": "[C][C][=C][C][=C][C][=C][Branch1][P][O][C][C][Branch1][C][O][C][O][C][C][C][O][C][C][Ring1][=Branch1][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][Ring2]",
"smiles": "CC=Cc1ccc(OCC(O)COC2CCOCC2)c(OC)c1"
} | 1-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-3-(oxan-4-yloxy)propan-2-ol | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Determine the IUPAC name for the molecule represented by the following SMILES representation: <molecule_2d> .",
"role": "user"
},
{
"content": "1-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-3-(oxan-4-yloxy)propan-2-ol",
"role": "assistant"
}
] |
297,916 | {
"selfies": "[C][O][C][=C][C][=C][C][Branch2][Ring1][#C][C][Branch1][C][F][C][N][C][C][C][Branch1][P][N][C][=N][C][=C][Branch1][C][N][N][=C][N][=C][Ring1][#Branch1][Ring1][#Branch2][C][Ring1][#C][=C][Ring2][Ring1][Branch2]",
"smiles": "COc1cccc(C(F)CN2CCC(n3cnc4c(N)ncnc43)C2)c1"
} | 9-[1-[2-fluoro-2-(3-methoxyphenyl)ethyl]pyrrolidin-3-yl]purin-6-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": "9-[1-[2-fluoro-2-(3-methoxyphenyl)ethyl]pyrrolidin-3-yl]purin-6-amine",
"role": "assistant"
}
] |
297,917 | {
"selfies": "[C][C][C][C][Branch1][C][O][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C][=N][N][Branch1][C][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][Cl][C][Ring2][Ring1][Ring2]",
"smiles": "CC1CC(O)CN(C(=O)c2nn(C)c(C(F)(F)F)c2Cl)C1"
} | [4-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-[(3S,5R)-3-hydroxy-5-methylpiperidin-1-yl]methanone | [
{
"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-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-[(3S,5R)-3-hydroxy-5-methylpiperidin-1-yl]methanone",
"role": "assistant"
}
] |
297,918 | {
"selfies": "[C][C][=C][C][=C][N][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][N][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][Ring1][O][C]",
"smiles": "Cc1cccnc1S(=O)(=O)N1CCN(CC(C)C)C(=O)C1C"
} | 3-methyl-1-(2-methylpropyl)-4-(3-methylpyridin-2-yl)sulfonylpiperazin-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": "3-methyl-1-(2-methylpropyl)-4-(3-methylpyridin-2-yl)sulfonylpiperazin-2-one",
"role": "assistant"
}
] |
297,919 | {
"selfies": "[C][C][Branch1][=Branch2][C][=C][C][=N][N][Ring1][Branch1][C][N][Branch1][S][C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][=Branch1][C][=O][C][Cl]",
"smiles": "CC(c1ccnn1C)N(Cc1ccc2ccccc2c1)C(=O)CCl"
} | 2-chloro-N-[1-(2-methylpyrazol-3-yl)ethyl]-N-(naphthalen-2-ylmethyl)acetamide | [
{
"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-chloro-N-[1-(2-methylpyrazol-3-yl)ethyl]-N-(naphthalen-2-ylmethyl)acetamide",
"role": "assistant"
}
] |
297,920 | {
"selfies": "[C][O][C][C][C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][Branch2][N][C][=N][N][=N][Ring1][Branch1][C][=C][Ring1][O][C][C][C][C][Ring2][Ring1][Ring2]",
"smiles": "COCCC1(NC(=O)Cc2ccc(-n3cnnn3)cc2)CCCC1"
} | N-[1-(2-methoxyethyl)cyclopentyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?",
"role": "user"
},
{
"content": "N-[1-(2-methoxyethyl)cyclopentyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide",
"role": "assistant"
}
] |
297,921 | {
"selfies": "[C][N][Branch1][C][C][C][=N][C][Branch1][C][Cl][=C][Branch2][Ring1][Branch1][C][N][C][C][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][N][Ring2][Ring1][Ring2][C]",
"smiles": "CN(C)c1nc(Cl)c(CNC2CCCC(c3ccccc3)C2)n1C"
} | 4-chloro-N,N,1-trimethyl-5-[[(3-phenylcyclohexyl)amino]methyl]imidazol-2-amine | [
{
"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-chloro-N,N,1-trimethyl-5-[[(3-phenylcyclohexyl)amino]methyl]imidazol-2-amine",
"role": "assistant"
}
] |
297,922 | {
"selfies": "[O][=C][Branch1][#Branch2][N][C][C][N][C][C][C][Ring1][Ring2][C][=C][C][=C][N][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][NH1][C][Ring1][N][=C][Ring1][S]",
"smiles": "O=C(NCCN1CCC1)c1ccc2nc(-c3ccc(Cl)cc3)[nH]c2c1"
} | N-[2-(azetidin-1-yl)ethyl]-2-(4-chlorophenyl)-3H-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> The above is a SMILES representation. Write the IUPAC name of the corresponding molecule.",
"role": "user"
},
{
"content": "N-[2-(azetidin-1-yl)ethyl]-2-(4-chlorophenyl)-3H-benzimidazole-5-carboxamide",
"role": "assistant"
}
] |
297,923 | {
"selfies": "[C][C][=N][C][=C][C][Branch1][#C][N][C][C][=C][N][C][=C][N][=C][Ring1][Branch1][S][Ring1][Branch2][=C][C][=C][Ring1][S][N][Ring2][Ring1][Ring1][C][Branch1][C][C][C][O]",
"smiles": "Cc1nc2cc(NCc3cn4ccnc4s3)ccc2n1C(C)CO"
} | 2-[5-(imidazo[2,1-b][1,3]thiazol-2-ylmethylamino)-2-methylbenzimidazol-1-yl]propan-1-ol | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Translate the given SMILES formula of a molecule <molecule_2d> into its IUPAC name.",
"role": "user"
},
{
"content": "2-[5-(imidazo[2,1-b][1,3]thiazol-2-ylmethylamino)-2-methylbenzimidazol-1-yl]propan-1-ol",
"role": "assistant"
}
] |
297,924 | {
"selfies": "[C][N][Branch1][P][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][=Branch1][C][=O][C][C][C][C][N][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1]",
"smiles": "CN(Cc1ccc([N+](=O)[O-])cc1)C(=O)C1CCCN1Cc1ccccc1"
} | (2S)-1-benzyl-N-methyl-N-[(4-nitrophenyl)methyl]pyrrolidine-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": "(2S)-1-benzyl-N-methyl-N-[(4-nitrophenyl)methyl]pyrrolidine-2-carboxamide",
"role": "assistant"
}
] |
297,925 | {
"selfies": "[C][C][N][C][Branch1][N][C][=C][C][=C][Branch1][Ring1][C][O][O][Ring1][#Branch1][=N][N][=C][Ring1][N][N][C][C][C][C][C][=Branch1][C][=O][N][C][C][Ring1][=Branch1][Ring1][#Branch2]",
"smiles": "CCn1c(-c2ccc(CO)o2)nnc1N1CCCC2C(=O)NCC21"
} | (4aR,7aS)-1-[4-ethyl-5-[5-(hydroxymethyl)furan-2-yl]-1,2,4-triazol-3-yl]-3,4,4a,6,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridin-5-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": "(4aR,7aS)-1-[4-ethyl-5-[5-(hydroxymethyl)furan-2-yl]-1,2,4-triazol-3-yl]-3,4,4a,6,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridin-5-one",
"role": "assistant"
}
] |
297,926 | {
"selfies": "[N][C][=Branch2][Ring1][S][=N][O][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][S][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2]",
"smiles": "NC(=NOCC(=O)N1Cc2ccccc2C(c2ccccc2)C1)c1cccc(C(F)(F)F)c1"
} | N'-[2-oxo-2-(4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)ethoxy]-3-(trifluoromethyl)benzenecarboximidamide | [
{
"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-oxo-2-(4-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)ethoxy]-3-(trifluoromethyl)benzenecarboximidamide",
"role": "assistant"
}
] |
297,927 | {
"selfies": "[C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][=Branch2]",
"smiles": "CCC(=O)Nc1ccc(OC)cc1NC(=O)Cc1cc2ccccc2s1"
} | N-[2-[[2-(1-benzothiophen-2-yl)acetyl]amino]-4-methoxyphenyl]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": "N-[2-[[2-(1-benzothiophen-2-yl)acetyl]amino]-4-methoxyphenyl]propanamide",
"role": "assistant"
}
] |
297,928 | {
"selfies": "[C][C][Branch2][Ring1][=Branch2][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][NH1][C][=Branch1][C][=O][NH1][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][=C][N][Branch1][C][C][N][=N][Ring1][=Branch1]",
"smiles": "CC(NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1)c1cn(C)nn1"
} | N-[(1S)-1-(1-methyltriazol-4-yl)ethyl]-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Determine the IUPAC name for the molecule denoted by <molecule_2d> .",
"role": "user"
},
{
"content": "N-[(1S)-1-(1-methyltriazol-4-yl)ethyl]-2-oxo-1,3-dihydrobenzimidazole-5-sulfonamide",
"role": "assistant"
}
] |
297,929 | {
"selfies": "[C][O][C][C][=N][C][Branch1][C][C][=C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][O][C][C][S][C][=N][C][=C][N][Ring1][Branch1][C][Ring1][=Branch2][S][Ring2][Ring1][C]",
"smiles": "COCc1nc(C)c(C(=O)OC2CSc3nccn3C2)s1"
} | 6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-6-yl 2-(methoxymethyl)-4-methyl-1,3-thiazole-5-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": "6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-6-yl 2-(methoxymethyl)-4-methyl-1,3-thiazole-5-carboxylate",
"role": "assistant"
}
] |
297,930 | {
"selfies": "[C][O][C][C][=C][C][Branch1][S][C][N][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=Branch1][C][=O][O][=C][S][Ring1][=C]",
"smiles": "COCc1cc(-c2nnn(C)c2C(=O)O)cs1"
} | 5-[5-(methoxymethyl)thiophen-3-yl]-3-methyltriazole-4-carboxylic acid | [
{
"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-[5-(methoxymethyl)thiophen-3-yl]-3-methyltriazole-4-carboxylic acid",
"role": "assistant"
}
] |
297,931 | {
"selfies": "[O][=C][Branch1][C][O][C][C][N][C][C][C][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][N][Ring1][O][C][Ring1][#C]",
"smiles": "O=C(O)CCNC1CCc2nc(-c3ccccc3)cn2C1"
} | 3-[(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]propanoic acid | [
{
"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-[(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]propanoic acid",
"role": "assistant"
}
] |
297,932 | {
"selfies": "[C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][S][C][Branch1][=Branch2][C][C][C][C][N][C][Ring1][Branch1][=N][Ring1][O][C][=C][C][=C][N][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2]",
"smiles": "CN(C(=O)c1csc(CC2CCNC2)n1)c1ccc2ncccc2c1"
} | N-methyl-2-(pyrrolidin-3-ylmethyl)-N-quinolin-6-yl-1,3-thiazole-4-carboxamide | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?",
"role": "user"
},
{
"content": "N-methyl-2-(pyrrolidin-3-ylmethyl)-N-quinolin-6-yl-1,3-thiazole-4-carboxamide",
"role": "assistant"
}
] |
297,933 | {
"selfies": "[O][=C][Branch1][N][C][C][C][C][C][C][N][C][C][Ring1][=Branch1][N][Branch1][O][C][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][C][=C][C][=N][C][=C][Ring1][=Branch1]",
"smiles": "O=C(CCCC1CCNCC1)N(CCc1ccccn1)Cc1ccncc1"
} | 4-piperidin-4-yl-N-(2-pyridin-2-ylethyl)-N-(pyridin-4-ylmethyl)butanamide | [
{
"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-piperidin-4-yl-N-(2-pyridin-2-ylethyl)-N-(pyridin-4-ylmethyl)butanamide",
"role": "assistant"
}
] |
297,934 | {
"selfies": "[C][O][C][=C][C][=C][C][Branch2][Ring1][#Branch1][C][Branch1][C][C][N][C][=C][C][=C][N][=C][NH1][C][=Branch1][C][=O][C][Ring1][#Branch1][=N][Ring1][O][=N][Ring2][Ring1][Ring2]",
"smiles": "COc1cccc(C(C)Nc2ccc3nc[nH]c(=O)c3n2)n1"
} | 6-[1-(6-methoxypyridin-2-yl)ethylamino]-3H-pyrido[3,2-d]pyrimidin-4-one | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Can you give the IUPAC name of the molecule <molecule_2d> ?",
"role": "user"
},
{
"content": "6-[1-(6-methoxypyridin-2-yl)ethylamino]-3H-pyrido[3,2-d]pyrimidin-4-one",
"role": "assistant"
}
] |
297,935 | {
"selfies": "[N][C][C][=Branch1][C][=O][N][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][C][=C][C][=C][C][=C][Ring1][#C][Ring1][=Branch1]",
"smiles": "NCC(=O)NCC(c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12"
} | 2-amino-N-[2-phenyl-2-(2-phenyl-1H-indol-3-yl)ethyl]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-amino-N-[2-phenyl-2-(2-phenyl-1H-indol-3-yl)ethyl]acetamide",
"role": "assistant"
}
] |
297,936 | {
"selfies": "[C][O][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][N][Branch2][Ring1][C][C][C][=C][Branch1][C][Cl][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][=Branch2][Cl][C][Ring2][Ring1][Ring1]",
"smiles": "COCC1(C(=O)O)CCN(Cc2c(Cl)cc(OC)cc2Cl)C1"
} | 1-[(2,6-dichloro-4-methoxyphenyl)methyl]-3-(methoxymethyl)pyrrolidine-3-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": "1-[(2,6-dichloro-4-methoxyphenyl)methyl]-3-(methoxymethyl)pyrrolidine-3-carboxylic acid",
"role": "assistant"
}
] |
297,937 | {
"selfies": "[C][C][N][C][=C][Branch2][Ring1][=Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][Branch2][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=N][Ring2][Ring1][Ring1]",
"smiles": "CCn1cc(-c2ccc3c(c2)CC(C)(C)O3)c(C(=O)O)n1"
} | 4-(2,2-dimethyl-3H-1-benzofuran-5-yl)-1-ethylpyrazole-3-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-(2,2-dimethyl-3H-1-benzofuran-5-yl)-1-ethylpyrazole-3-carboxylic acid",
"role": "assistant"
}
] |
297,938 | {
"selfies": "[N][C][C][C][C][N][Branch2][Ring1][P][C][=Branch1][C][=O][C][=C][N][=C][Branch2][Ring1][C][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][N][Ring1][#Branch1][N][=C][Ring1][P][C][Ring2][Ring1][=Branch2]",
"smiles": "NC1CCCN(C(=O)c2cnc(Nc3ccc4c(c3)CCCN4)nc2)C1"
} | (3-aminopiperidin-1-yl)-[2-(1,2,3,4-tetrahydroquinolin-6-ylamino)pyrimidin-5-yl]methanone | [
{
"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-aminopiperidin-1-yl)-[2-(1,2,3,4-tetrahydroquinolin-6-ylamino)pyrimidin-5-yl]methanone",
"role": "assistant"
}
] |
297,939 | {
"selfies": "[C][=C][C][=C][Branch1][C][O][N][=C][C][=C][C][=Branch2][Ring1][C][=N+1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][C][Branch1][C][Cl][=C][Ring2][Ring1][C]",
"smiles": "C=CC=C(O)N=C1C=CC(=[N+]2C(=O)c3ccccc3C2=O)C(Cl)=C1"
} | 2-[(4E)-2-chloro-4-[(1E)-1-hydroxybuta-1,3-dienyl]iminocyclohexa-2,5-dien-1-ylidene]isoindol-2-ium-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 SMILES representation of a molecule <molecule_2d> into IUPAC name.",
"role": "user"
},
{
"content": "2-[(4E)-2-chloro-4-[(1E)-1-hydroxybuta-1,3-dienyl]iminocyclohexa-2,5-dien-1-ylidene]isoindol-2-ium-1,3-dione",
"role": "assistant"
}
] |
297,940 | {
"selfies": "[O][=C][Branch2][Ring1][Ring1][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][O][Ring1][Branch2][C][=C][C][=C][Branch1][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][NH1][C][Ring1][=N][=O]",
"smiles": "O=C(Oc1ccc2c(c1)OCCCO2)c1ccc(-c2cccc(Cl)c2)[nH]c1=O"
} | 3,4-dihydro-2H-1,5-benzodioxepin-7-yl 6-(3-chlorophenyl)-2-oxo-1H-pyridine-3-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": "3,4-dihydro-2H-1,5-benzodioxepin-7-yl 6-(3-chlorophenyl)-2-oxo-1H-pyridine-3-carboxylate",
"role": "assistant"
}
] |
297,941 | {
"selfies": "[C][#C][C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Branch1][C][N][=C][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][N][Ring1][O][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][C][C][C][Ring2][Ring1][#Branch2]",
"smiles": "C#CCC1(C(=O)N2CCC3(C2)c2ncn(C)c2CCN3C(=O)C2CC2C)CCC1"
} | [(1S,2S)-2-methylcyclopropyl]-[1-methyl-1'-(1-prop-2-ynylcyclobutanecarbonyl)spiro[6,7-dihydroimidazo[4,5-c]pyridine-4,3'-pyrrolidine]-5-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": "[(1S,2S)-2-methylcyclopropyl]-[1-methyl-1'-(1-prop-2-ynylcyclobutanecarbonyl)spiro[6,7-dihydroimidazo[4,5-c]pyridine-4,3'-pyrrolidine]-5-yl]methanone",
"role": "assistant"
}
] |
297,942 | {
"selfies": "[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][C][N][Branch1][#Branch2][C][C][C][=N][C][=C][NH1][Ring1][Branch1][C][C][Ring1][=N]",
"smiles": "CC(C)(C)OC(=O)NC1CCN(CCc2ncc[nH]2)CC1"
} | tert-butyl N-[1-[2-(1H-imidazol-2-yl)ethyl]piperidin-4-yl]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 of the molecule <molecule_2d> ?",
"role": "user"
},
{
"content": "tert-butyl N-[1-[2-(1H-imidazol-2-yl)ethyl]piperidin-4-yl]carbamate",
"role": "assistant"
}
] |
297,943 | {
"selfies": "[C][C][C][C][C][C][Ring1][Branch1][Branch2][Ring1][N][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=N][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][=C][Ring1][N][C][=Branch1][C][=O][O]",
"smiles": "CC1CCCC1(NC(=O)c1cccc(C2CC(F)(F)C2)c1)C(=O)O"
} | 1-[[3-(3,3-difluorocyclobutyl)benzoyl]amino]-2-methylcyclopentane-1-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": "1-[[3-(3,3-difluorocyclobutyl)benzoyl]amino]-2-methylcyclopentane-1-carboxylic acid",
"role": "assistant"
}
] |
297,944 | {
"selfies": "[O][=C][Branch1][=C][C][C][=C][NH1][C][=Ring1][Branch1][C][C][C][C][Ring1][Ring2][N][C][C][C][C][Ring1][Branch1]",
"smiles": "O=C(c1cc[nH]c1C1CCC1)N1CCCC1"
} | (2-cyclobutyl-1H-pyrrol-3-yl)-pyrrolidin-1-ylmethanone | [
{
"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-cyclobutyl-1H-pyrrol-3-yl)-pyrrolidin-1-ylmethanone",
"role": "assistant"
}
] |
297,945 | {
"selfies": "[O][=C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][N][=C][N][Ring1][O][C][C][S][N][=C][C][=Ring1][Branch1][Br]",
"smiles": "O=c1c2cccc(F)c2ncn1Cc1sncc1Br"
} | 3-[(4-bromo-1,2-thiazol-5-yl)methyl]-8-fluoroquinazolin-4-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": "3-[(4-bromo-1,2-thiazol-5-yl)methyl]-8-fluoroquinazolin-4-one",
"role": "assistant"
}
] |
297,946 | {
"selfies": "[C][N][C][=Branch1][C][=O][NH1][C][=N][C][=C][Branch2][Ring1][P][C][=C][C][=C][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][C][C][C][C][Ring1][=Branch2][=C][Ring2][Ring1][C][C][=C][Ring2][Ring1][Branch2][Ring2][Ring1][N]",
"smiles": "Cn1c(=O)[nH]c2ncc(-c3cccc(C(=O)NC4(C(N)=O)CCCCC4)c3)cc21"
} | N-(1-carbamoylcyclohexyl)-3-(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-6-yl)benzamide | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Can you give the IUPAC name of the molecule <molecule_2d> ?",
"role": "user"
},
{
"content": "N-(1-carbamoylcyclohexyl)-3-(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-6-yl)benzamide",
"role": "assistant"
}
] |
297,947 | {
"selfies": "[C][C][=C][C][Branch1][Branch2][O][C][C][=Branch1][C][=O][O][=C][C][=C][Ring1][O][C][C][=N][N][Branch1][C][C][N][=Ring1][=Branch1]",
"smiles": "Cc1cc(OCC(=O)O)ccc1-c1cnn(C)n1"
} | 2-[3-methyl-4-(2-methyltriazol-4-yl)phenoxy]acetic 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-[3-methyl-4-(2-methyltriazol-4-yl)phenoxy]acetic acid",
"role": "assistant"
}
] |
297,948 | {
"selfies": "[C][C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][N][C][=N][C][=C][C][=C][Ring1][=Branch1][N][C][C][C][Ring1][O][C][Ring1][Branch1][C][=C][C][=C][C][Branch1][=Branch2][N][C][C][N][C][Ring1][Branch1][=O][=C][Ring1][N]",
"smiles": "CC(NC(=O)N1c2ncccc2N2CCC1C2)c1cccc(N2CCNC2=O)c1"
} | N-[1-[3-(2-oxoimidazolidin-1-yl)phenyl]ethyl]-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Convert the following SMILES notation <molecule_2d> into its IUPAC nomenclature.",
"role": "user"
},
{
"content": "N-[1-[3-(2-oxoimidazolidin-1-yl)phenyl]ethyl]-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide",
"role": "assistant"
}
] |
297,949 | {
"selfies": "[C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch2][Ring1][Ring1][C][N][C][=N][C][=N][C][C][=N][N][Branch1][C][C][C][Ring1][#Branch2][=Ring1][=Branch1][C][=C][C][=C][Ring2][Ring1][=Branch1][Ring2][Ring1][C]",
"smiles": "COC(=O)c1cccc2c(CNc3ncnc4cnn(C)c34)cccc12"
} | methyl 5-[[(1-methylpyrazolo[4,3-d]pyrimidin-7-yl)amino]methyl]naphthalene-1-carboxylate | [
{
"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": "methyl 5-[[(1-methylpyrazolo[4,3-d]pyrimidin-7-yl)amino]methyl]naphthalene-1-carboxylate",
"role": "assistant"
}
] |
297,950 | {
"selfies": "[N][C][=Branch1][C][=O][C][C][C][N][Branch2][Ring2][#Branch1][C][C][=C][C][=C][Branch2][Ring1][#Branch2][C][N][C][=Branch1][C][=O][C][=C][N][Branch1][O][C][C][C][C][C][C][C][N][Ring1][=Branch1][N][=N][Ring1][=N][C][=C][Ring2][Ring1][#Branch1][C][C][Ring2][Ring1][=C]",
"smiles": "NC(=O)C1CCN(Cc2ccc(CNC(=O)c3cn(CCC4CCCCN4)nn3)cc2)CC1"
} | 1-[[4-[[[1-(2-piperidin-2-ylethyl)triazole-4-carbonyl]amino]methyl]phenyl]methyl]piperidine-4-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": "1-[[4-[[[1-(2-piperidin-2-ylethyl)triazole-4-carbonyl]amino]methyl]phenyl]methyl]piperidine-4-carboxamide",
"role": "assistant"
}
] |
297,951 | {
"selfies": "[O][=C][Branch2][Ring1][Branch1][N][C][C][N][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][=Branch2][N][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][C][O][C][C][O][Ring1][=Branch1]",
"smiles": "O=C(NCCn1ccc(C(F)(F)F)n1)NC(C1CC1)C1COCCO1"
} | 1-[cyclopropyl(1,4-dioxan-2-yl)methyl]-3-[2-[3-(trifluoromethyl)pyrazol-1-yl]ethyl]urea | [
{
"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-[cyclopropyl(1,4-dioxan-2-yl)methyl]-3-[2-[3-(trifluoromethyl)pyrazol-1-yl]ethyl]urea",
"role": "assistant"
}
] |
297,952 | {
"selfies": "[C][C][C][S][C][Branch2][Ring1][=Branch2][N][C][C][C][Branch1][S][N][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][N][=N][Ring1][=Branch2][C][Ring1][=C][=N][C][=Ring2][Ring1][Ring1][C]",
"smiles": "CCc1sc(N2CCC(n3cc(C(=O)OC)nn3)C2)nc1C"
} | methyl 1-[1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-yl]triazole-4-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 denoted by <molecule_2d> .",
"role": "user"
},
{
"content": "methyl 1-[1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-yl]triazole-4-carboxylate",
"role": "assistant"
}
] |
297,953 | {
"selfies": "[C][C][=C][C][=C][Branch2][Ring1][N][C][C][Branch1][C][C][C][C][C][N][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][C][=N][O][C][=Ring1][Branch1][C][=C][Ring2][Ring1][#Branch1]",
"smiles": "Cc1ccc(C2C(C)CCCN2S(=O)(=O)CCc2cnoc2)cc1"
} | 4-[2-[(2S,3R)-3-methyl-2-(4-methylphenyl)piperidin-1-yl]sulfonylethyl]-1,2-oxazole | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "<molecule_2d> is the SMILES representation of a molecule. What is its IUPAC name?",
"role": "user"
},
{
"content": "4-[2-[(2S,3R)-3-methyl-2-(4-methylphenyl)piperidin-1-yl]sulfonylethyl]-1,2-oxazole",
"role": "assistant"
}
] |
297,954 | {
"selfies": "[N][C][C][C][=C][C][=N][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][Ring1][C][O][C][Branch1][Ring2][C][C][O][C][Ring1][#Branch2][=C][N][Ring1][P][C][=Ring2][Ring1][Branch1]",
"smiles": "NCc1ccc2nc(C(=O)N3CC(CO)C(CCO)C3)cn2c1"
} | [6-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(2-hydroxyethyl)-4-(hydroxymethyl)pyrrolidin-1-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": "[6-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-[3-(2-hydroxyethyl)-4-(hydroxymethyl)pyrrolidin-1-yl]methanone",
"role": "assistant"
}
] |
297,955 | {
"selfies": "[C][N][C][=C][Branch2][Ring1][P][C][C][C][C][Ring1][Ring2][C][C][N][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][C][=N][Ring2][Ring1][#Branch1]",
"smiles": "Cn1cc(C23CCC2CCN3S(=O)(=O)CC2CCC(F)(F)C2)cn1"
} | 2-[(3,3-difluorocyclopentyl)methylsulfonyl]-1-(1-methylpyrazol-4-yl)-2-azabicyclo[3.2.0]heptane | [
{
"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-[(3,3-difluorocyclopentyl)methylsulfonyl]-1-(1-methylpyrazol-4-yl)-2-azabicyclo[3.2.0]heptane",
"role": "assistant"
}
] |
297,956 | {
"selfies": "[C][C][C][N][C][Branch2][Ring1][Ring1][C][N][C][C][C][Branch1][C][O][C][Ring1][Branch1][N][C][=C][C][=N][Ring1][Branch1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][Branch1]",
"smiles": "CCCn1c(CNC2CC(O)C2n2cccn2)nc2ccccc21"
} | (1R,2R,3S)-3-[(1-propylbenzimidazol-2-yl)methylamino]-2-pyrazol-1-ylcyclobutan-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 for the molecule whose SMILES representation is <molecule_2d> ?",
"role": "user"
},
{
"content": "(1R,2R,3S)-3-[(1-propylbenzimidazol-2-yl)methylamino]-2-pyrazol-1-ylcyclobutan-1-ol",
"role": "assistant"
}
] |
297,957 | {
"selfies": "[C][C][C][C][C][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][S][C][C][Branch1][C][C][C]",
"smiles": "CCCCCC(C(=O)Nc1cc(Br)ccc1SC)C(C)C"
} | N-(5-bromo-2-methylsulfanylphenyl)-2-propan-2-ylheptanamide | [
{
"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-(5-bromo-2-methylsulfanylphenyl)-2-propan-2-ylheptanamide",
"role": "assistant"
}
] |
297,958 | {
"selfies": "[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][NH1][N][=C][C][=Ring1][Branch1][Ring1][=Branch2][C][C][Ring1][P][=C][Ring2][Ring1][#Branch1][C]",
"smiles": "Cc1cccc(N2CCN(C(=O)C3CCCc4[nH]ncc43)CC2)c1C"
} | [4-(2,3-dimethylphenyl)piperazin-1-yl]-(4,5,6,7-tetrahydro-1H-indazol-4-yl)methanone | [
{
"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-(2,3-dimethylphenyl)piperazin-1-yl]-(4,5,6,7-tetrahydro-1H-indazol-4-yl)methanone",
"role": "assistant"
}
] |
297,959 | {
"selfies": "[C][C][=C][C][=Branch1][C][=O][C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring2][C][=C][C][=C][C][=C][Ring1][=Branch1][F][=C][N][Ring2][Ring1][Ring2][C][C][C][Ring1][Ring1]",
"smiles": "Cc1cc(=O)c(C(=O)N2CCC2c2ccccc2F)cn1C1CC1"
} | 1-cyclopropyl-5-[2-(2-fluorophenyl)azetidine-1-carbonyl]-2-methylpyridin-4-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-cyclopropyl-5-[2-(2-fluorophenyl)azetidine-1-carbonyl]-2-methylpyridin-4-one",
"role": "assistant"
}
] |
297,960 | {
"selfies": "[C][C][Branch1][C][C][C][C][=C][C][=C][C][Branch2][Ring1][Ring2][C][O][C][=C][C][=C][Branch1][Branch2][N][C][=N][N][=N][Ring1][Branch1][C][=C][Ring1][O][=C][Ring2][Ring1][Ring1][O][Ring2][Ring1][#Branch1]",
"smiles": "CC1(C)Cc2cccc(COc3ccc(-n4cnnn4)cc3)c2O1"
} | 1-[4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methoxy]phenyl]tetrazole | [
{
"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-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methoxy]phenyl]tetrazole",
"role": "assistant"
}
] |
297,961 | {
"selfies": "[O][=C][Branch2][Ring1][Ring2][N][C][C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][O][N][=Ring1][O][N][C][C][C][Branch1][C][O][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][Ring1][=N]",
"smiles": "O=C(NCc1cc(-c2ccccn2)on1)N1CCC(O)(c2ccccc2F)C1"
} | 3-(2-fluorophenyl)-3-hydroxy-N-[(5-pyridin-2-yl-1,2-oxazol-3-yl)methyl]pyrrolidine-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 denoted by <molecule_2d> .",
"role": "user"
},
{
"content": "3-(2-fluorophenyl)-3-hydroxy-N-[(5-pyridin-2-yl-1,2-oxazol-3-yl)methyl]pyrrolidine-1-carboxamide",
"role": "assistant"
}
] |
297,962 | {
"selfies": "[O][=S][=Branch1][C][=O][Branch1][=C][C][=C][C][=N][N][Ring1][Branch1][C][C][C][C][Ring1][Ring1][N][C][C][C][C][Ring1][Branch1][C][C][Branch1][C][O][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=C]",
"smiles": "O=S(=O)(c1ccnn1CC1CC1)N1C2CCC1CC(O)(c1ccccc1)C2"
} | 8-[2-(cyclopropylmethyl)pyrazol-3-yl]sulfonyl-3-phenyl-8-azabicyclo[3.2.1]octan-3-ol | [
{
"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-[2-(cyclopropylmethyl)pyrazol-3-yl]sulfonyl-3-phenyl-8-azabicyclo[3.2.1]octan-3-ol",
"role": "assistant"
}
] |
297,963 | {
"selfies": "[C][O][C][=C][C][=C][C][=C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][=C][C][Branch1][C][C][=N][O][Ring1][=Branch1][C][=C][C][Ring2][Ring1][Ring1][=N][Ring2][Ring1][#Branch1]",
"smiles": "COc1ccc2cc(NC(=O)C(=O)NCc3cc(C)no3)ccc2n1"
} | N'-(2-methoxyquinolin-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]oxamide | [
{
"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-methoxyquinolin-6-yl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]oxamide",
"role": "assistant"
}
] |
Subsets and Splits