2-(4-methylphenyl)-3-(4-methylsulfanylphenyl)carbonyl-4-phenyl-5-piperazin-1-ylcarbonyl-N-propan-2-yl-pyrrolidine-1-carboxamide

Systemtic Name: 2-(4-methylphenyl)-3-(4-methylsulfanylphenyl)carbonyl-4-phenyl-5-piperazin-1-ylcarbonyl-N-propan-2-yl-pyrrolidine-1-carboxamide Openeye Name: N-isopropyl-4-(4-methylsulfanylbenzoyl)-3-phenyl-2-(piperazine-1-carbonyl)-5-(p-tolyl)pyrrolidine-1-carboxamide CAS Name: 2-(4-methylphenyl)-3-[[4-(methylthio)phenyl]-oxomethyl]-5-[oxo(1-piperazinyl)methyl]-4-phenyl-N-propan-2-yl-1-pyrrolidinecarboxamide IUPAC Name: 2-(4-methylphenyl)-3-(4-methylsulfanylbenzoyl)-4-phenyl-5-(piperazine-1-carbonyl)-N-propan-2-ylpyrrolidine-1-carboxamide Traditional Name: N-isopropyl-4-[4-(methylthio)benzoyl]-3-phenyl-2-(piperazine-1-carbonyl)-5-(p-tolyl)pyrrolidine-1-carboxamide Formula: C34H40N4O3S MolecularWeight: 584.7714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(C(N2C(=O)NC(C)C)C(=O)N3CCNCC3)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)SC

Isomeric SMILES

CC1=CC=C(C=C1)C2C(C(C(N2C(=O)NC(C)C)C(=O)N3CCNCC3)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)SC

InChI

InChI=1S/C34H40N4O3S/c1-22(2)36-34(41)38-30(25-12-10-23(3)11-13-25)29(32(39)26-14-16-27(42-4)17-15-26)28(24-8-6-5-7-9-24)31(38)33(40)37-20-18-35-19-21-37/h5-17,22,28-31,35H,18-21H2,1-4H3,(H,36,41)