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

Systemtic Name: 4-(4-chlorophenyl)-N-(3-methylphenyl)-2-(3-methylthiophen-2-yl)-5-piperazin-1-ylcarbonyl-3-thiophen-2-ylcarbonyl-pyrrolidine-1-carboxamide Openeye Name: 4-(4-chlorophenyl)-2-(3-methyl-2-thienyl)-N-(m-tolyl)-5-(piperazine-1-carbonyl)-3-(thiophene-2-carbonyl)pyrrolidine-1-carboxamide CAS Name: 4-(4-chlorophenyl)-N-(3-methylphenyl)-2-(3-methyl-2-thiophenyl)-5-[oxo(1-piperazinyl)methyl]-3-[oxo(thiophen-2-yl)methyl]-1-pyrrolidinecarboxamide IUPAC Name: 4-(4-chlorophenyl)-N-(3-methylphenyl)-2-(3-methylthiophen-2-yl)-5-(piperazine-1-carbonyl)-3-(thiophene-2-carbonyl)pyrrolidine-1-carboxamide Traditional Name: 4-(4-chlorophenyl)-2-(3-methyl-2-thienyl)-N-(m-tolyl)-5-(piperazine-1-carbonyl)-3-(2-thenoyl)pyrrolidine-1-carboxamide Formula: C33H33ClN4O3S2 MolecularWeight: 633.22312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2C(C(C(C2C(=O)N3CCNCC3)C4=CC=C(C=C4)Cl)C(=O)C5=CC=CS5)C6=C(C=CS6)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2C(C(C(C2C(=O)N3CCNCC3)C4=CC=C(C=C4)Cl)C(=O)C5=CC=CS5)C6=C(C=CS6)C

InChI

InChI=1S/C33H33ClN4O3S2/c1-20-5-3-6-24(19-20)36-33(41)38-28(31-21(2)12-18-43-31)27(30(39)25-7-4-17-42-25)26(22-8-10-23(34)11-9-22)29(38)32(40)37-15-13-35-14-16-37/h3-12,17-19,26-29,35H,13-16H2,1-2H3,(H,36,41)