ethyl 2-butyl-1-methylsulfanyl-3-[[4-[2-(phenylmethoxycarbonylsulfamoyl)phenyl]phenyl]methyl]-2H-imidazole-4-carboxylate

Systemtic Name: ethyl 2-butyl-1-methylsulfanyl-3-[[4-[2-(phenylmethoxycarbonylsulfamoyl)phenyl]phenyl]methyl]-2H-imidazole-4-carboxylate Openeye Name: ethyl 3-[[4-[2-(benzyloxycarbonylsulfamoyl)phenyl]phenyl]methyl]-2-butyl-1-methylsulfanyl-2H-imidazole-4-carboxylate CAS Name: 2-butyl-1-(methylthio)-3-[[4-[2-(phenylmethoxycarbonylsulfamoyl)phenyl]phenyl]methyl]-2H-imidazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-1-methylsulfanyl-3-[[4-[2-(phenylmethoxycarbonylsulfamoyl)phenyl]phenyl]methyl]-2H-imidazole-4-carboxylate Traditional Name: 2-butyl-3-[4-[2-(carbobenzoxysulfamoyl)phenyl]benzyl]-1-(methylthio)-4-imidazoline-4-carboxylic acid ethyl ester Formula: C32H37N3O6S2 MolecularWeight: 623.78268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1N(C=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)OCC4=CC=CC=C4)C(=O)OCC)SC

Isomeric SMILES

CCCCC1N(C=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)OCC4=CC=CC=C4)C(=O)OCC)SC

InChI

InChI=1S/C32H37N3O6S2/c1-4-6-16-30-34(28(22-35(30)42-3)31(36)40-5-2)21-24-17-19-26(20-18-24)27-14-10-11-15-29(27)43(38,39)33-32(37)41-23-25-12-8-7-9-13-25/h7-15,17-20,22,30H,4-6,16,21,23H2,1-3H3,(H,33,37)