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

Systemtic Name: 1-[(3-chlorophenyl)carbamoyl]-4-(4-methylphenyl)carbonyl-5-phenyl-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 1-[(3-chlorophenyl)carbamoyl]-4-(4-methylbenzoyl)-5-phenyl-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-chloroanilino)-oxomethyl]-4-[(4-methylphenyl)-oxomethyl]-5-phenyl-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-chlorophenyl)carbamoyl]-4-(4-methylbenzoyl)-5-phenyl-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 1-[(3-chlorophenyl)carbamoyl]-5-phenyl-4-p-toluoyl-3-(2-thienyl)proline Formula: C30H25ClN2O4S MolecularWeight: 545.0485

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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)Cl)C(=O)O)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2C(C(N(C2C3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)Cl)C(=O)O)C5=CC=CS5

InChI

InChI=1S/C30H25ClN2O4S/c1-18-12-14-20(15-13-18)28(34)25-24(23-11-6-16-38-23)27(29(35)36)33(26(25)19-7-3-2-4-8-19)30(37)32-22-10-5-9-21(31)17-22/h2-17,24-27H,1H3,(H,32,37)(H,35,36)