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

Systemtic Name: 3-(3-chlorophenyl)carbonyl-N,2-bis(3-methylphenyl)-5-piperazin-1-ylcarbonyl-4-thiophen-2-yl-pyrrolidine-1-carboxamide Openeye Name: 3-(3-chlorobenzoyl)-N,2-bis(m-tolyl)-5-(piperazine-1-carbonyl)-4-(2-thienyl)pyrrolidine-1-carboxamide CAS Name: 3-[(3-chlorophenyl)-oxomethyl]-N,2-bis(3-methylphenyl)-5-[oxo(1-piperazinyl)methyl]-4-thiophen-2-yl-1-pyrrolidinecarboxamide IUPAC Name: 3-(3-chlorobenzoyl)-N,2-bis(3-methylphenyl)-5-(piperazine-1-carbonyl)-4-thiophen-2-ylpyrrolidine-1-carboxamide Traditional Name: 3-(3-chlorobenzoyl)-N,2-bis(m-tolyl)-5-(piperazine-1-carbonyl)-4-(2-thienyl)pyrrolidine-1-carboxamide Formula: C35H35ClN4O3S MolecularWeight: 627.1954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2C(C(C(C2C(=O)N3CCNCC3)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl)C6=CC(=CC=C6)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2C(C(C(C2C(=O)N3CCNCC3)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl)C6=CC(=CC=C6)C

InChI

InChI=1S/C35H35ClN4O3S/c1-22-7-3-9-24(19-22)31-30(33(41)25-10-5-11-26(36)21-25)29(28-13-6-18-44-28)32(34(42)39-16-14-37-15-17-39)40(31)35(43)38-27-12-4-8-23(2)20-27/h3-13,18-21,29-32,37H,14-17H2,1-2H3,(H,38,43)