[1-[[4-(ethanoylsulfamoyl)phenyl]amino]-1-oxidanylidene-butan-2-yl] 2-methyl-4-(4-methylphenyl)-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: [1-[[4-(ethanoylsulfamoyl)phenyl]amino]-1-oxidanylidene-butan-2-yl] 2-methyl-4-(4-methylphenyl)-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: 1-[[4-(acetylsulfamoyl)phenyl]carbamoyl]propyl 2-methyl-1-oxo-4-(p-tolyl)isoquinoline-3-carboxylate CAS Name: 2-methyl-4-(4-methylphenyl)-1-oxo-3-isoquinolinecarboxylic acid [1-[4-(acetylsulfamoyl)anilino]-1-oxobutan-2-yl] ester IUPAC Name: [1-[4-(acetylsulfamoyl)anilino]-1-oxobutan-2-yl] 2-methyl-4-(4-methylphenyl)-1-oxoisoquinoline-3-carboxylate Traditional Name: 1-keto-2-methyl-4-(p-tolyl)isoquinoline-3-carboxylic acid 1-[[4-(acetylsulfamoyl)phenyl]carbamoyl]propyl ester Formula: C30H29N3O7S MolecularWeight: 575.63216

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(=O)C)OC(=O)C2=C(C3=CC=CC=C3C(=O)N2C)C4=CC=C(C=C4)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(=O)C)OC(=O)C2=C(C3=CC=CC=C3C(=O)N2C)C4=CC=C(C=C4)C

InChI

InChI=1S/C30H29N3O7S/c1-5-25(28(35)31-21-14-16-22(17-15-21)41(38,39)32-19(3)34)40-30(37)27-26(20-12-10-18(2)11-13-20)23-8-6-7-9-24(23)29(36)33(27)4/h6-17,25H,5H2,1-4H3,(H,31,35)(H,32,34)