4-(3-chlorophenyl)carbonyl-1-[(4-methoxyphenyl)carbamoyl]-2-methyl-5-(3-methylphenyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)carbonyl-1-[(4-methoxyphenyl)carbamoyl]-2-methyl-5-(3-methylphenyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(3-chlorobenzoyl)-1-[(4-methoxyphenyl)carbamoyl]-2-methyl-5-(m-tolyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 4-[(3-chlorophenyl)-oxomethyl]-1-[(4-methoxyanilino)-oxomethyl]-2-methyl-5-(3-methylphenyl)-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(3-chlorobenzoyl)-1-[(4-methoxyphenyl)carbamoyl]-2-methyl-5-(3-methylphenyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(3-chlorobenzoyl)-1-[(4-methoxyphenyl)carbamoyl]-2-methyl-5-(m-tolyl)-3-(2-thienyl)proline Formula: C32H29ClN2O5S MolecularWeight: 589.10106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C(C(C(N2C(=O)NC3=CC=C(C=C3)OC)(C)C(=O)O)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C2C(C(C(N2C(=O)NC3=CC=C(C=C3)OC)(C)C(=O)O)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C32H29ClN2O5S/c1-19-7-4-8-20(17-19)28-26(29(36)21-9-5-10-22(33)18-21)27(25-11-6-16-41-25)32(2,30(37)38)35(28)31(39)34-23-12-14-24(40-3)15-13-23/h4-18,26-28H,1-3H3,(H,34,39)(H,37,38)