3-(4-chlorophenyl)-N-(4-methylphenyl)-4-(phenylcarbonyl)-2-piperazin-1-ylcarbonyl-5-thiophen-2-yl-pyrrolidine-1-carboxamide

Systemtic Name: 3-(4-chlorophenyl)-N-(4-methylphenyl)-4-(phenylcarbonyl)-2-piperazin-1-ylcarbonyl-5-thiophen-2-yl-pyrrolidine-1-carboxamide Openeye Name: 4-benzoyl-3-(4-chlorophenyl)-2-(piperazine-1-carbonyl)-N-(p-tolyl)-5-(2-thienyl)pyrrolidine-1-carboxamide CAS Name: 4-benzoyl-3-(4-chlorophenyl)-N-(4-methylphenyl)-2-[oxo(1-piperazinyl)methyl]-5-thiophen-2-yl-1-pyrrolidinecarboxamide IUPAC Name: 4-benzoyl-3-(4-chlorophenyl)-N-(4-methylphenyl)-2-(piperazine-1-carbonyl)-5-thiophen-2-ylpyrrolidine-1-carboxamide Traditional Name: 4-benzoyl-3-(4-chlorophenyl)-2-(piperazine-1-carbonyl)-N-(p-tolyl)-5-(2-thienyl)pyrrolidine-1-carboxamide Formula: C34H33ClN4O3S MolecularWeight: 613.16882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2C(C(C(C2C(=O)N3CCNCC3)C4=CC=C(C=C4)Cl)C(=O)C5=CC=CC=C5)C6=CC=CS6

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2C(C(C(C2C(=O)N3CCNCC3)C4=CC=C(C=C4)Cl)C(=O)C5=CC=CC=C5)C6=CC=CS6

InChI

InChI=1S/C34H33ClN4O3S/c1-22-9-15-26(16-10-22)37-34(42)39-30(27-8-5-21-43-27)29(32(40)24-6-3-2-4-7-24)28(23-11-13-25(35)14-12-23)31(39)33(41)38-19-17-36-18-20-38/h2-16,21,28-31,36H,17-20H2,1H3,(H,37,42)