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

Systemtic Name: N-(3-methylphenyl)-3-(4-methylphenyl)carbonyl-2-phenyl-5-piperazin-1-ylcarbonyl-4-thiophen-2-yl-pyrrolidine-1-carboxamide Openeye Name: 3-(4-methylbenzoyl)-N-(m-tolyl)-2-phenyl-5-(piperazine-1-carbonyl)-4-(2-thienyl)pyrrolidine-1-carboxamide CAS Name: N-(3-methylphenyl)-4-[(4-methylphenyl)-oxomethyl]-2-[oxo(1-piperazinyl)methyl]-5-phenyl-3-thiophen-2-yl-1-pyrrolidinecarboxamide IUPAC Name: 3-(4-methylbenzoyl)-N-(3-methylphenyl)-2-phenyl-5-(piperazine-1-carbonyl)-4-thiophen-2-ylpyrrolidine-1-carboxamide Traditional Name: N-(m-tolyl)-2-phenyl-5-(piperazine-1-carbonyl)-3-p-toluoyl-4-(2-thienyl)pyrrolidine-1-carboxamide Formula: C35H36N4O3S MolecularWeight: 592.75034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2C(C(N(C2C3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C)C(=O)N5CCNCC5)C6=CC=CS6

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2C(C(N(C2C3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C)C(=O)N5CCNCC5)C6=CC=CS6

InChI

InChI=1S/C35H36N4O3S/c1-23-13-15-26(16-14-23)33(40)30-29(28-12-7-21-43-28)32(34(41)38-19-17-36-18-20-38)39(31(30)25-9-4-3-5-10-25)35(42)37-27-11-6-8-24(2)22-27/h3-16,21-22,29-32,36H,17-20H2,1-2H3,(H,37,42)