methyl 2-[methyl-[[4-(4-methylphenyl)sulfanylphenyl]methyl]sulfamoyl]-2-phenyl-4-pyrrolidin-1-yl-butanoate

Systemtic Name: methyl 2-[methyl-[[4-(4-methylphenyl)sulfanylphenyl]methyl]sulfamoyl]-2-phenyl-4-pyrrolidin-1-yl-butanoate Openeye Name: methyl 2-[methyl-[[4-(p-tolylsulfanyl)phenyl]methyl]sulfamoyl]-2-phenyl-4-pyrrolidin-1-yl-butanoate CAS Name: 2-[methyl-[[4-[(4-methylphenyl)thio]phenyl]methyl]sulfamoyl]-2-phenyl-4-(1-pyrrolidinyl)butanoic acid methyl ester IUPAC Name: methyl 2-[methyl-[[4-(4-methylphenyl)sulfanylphenyl]methyl]sulfamoyl]-2-phenyl-4-pyrrolidin-1-ylbutanoate Traditional Name: 2-[methyl-[4-(p-tolylthio)benzyl]sulfamoyl]-2-phenyl-4-pyrrolidino-butyric acid methyl ester Formula: C30H36N2O4S2 MolecularWeight: 552.74784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC=C(C=C2)CN(C)S(=O)(=O)C(CCN3CCCC3)(C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC=C(C=C2)CN(C)S(=O)(=O)C(CCN3CCCC3)(C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C30H36N2O4S2/c1-24-11-15-27(16-12-24)37-28-17-13-25(14-18-28)23-31(2)38(34,35)30(29(33)36-3,26-9-5-4-6-10-26)19-22-32-20-7-8-21-32/h4-6,9-18H,7-8,19-23H2,1-3H3