4-(3-chlorophenyl)carbonyl-2-methyl-1-(phenylcarbamoyl)-5-(2-phenylethenyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)carbonyl-2-methyl-1-(phenylcarbamoyl)-5-(2-phenylethenyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(3-chlorobenzoyl)-2-methyl-1-(phenylcarbamoyl)-5-styryl-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[anilino(oxo)methyl]-4-[(3-chlorophenyl)-oxomethyl]-2-methyl-5-(2-phenylethenyl)-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(3-chlorobenzoyl)-2-methyl-1-(phenylcarbamoyl)-5-(2-phenylethenyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(3-chlorobenzoyl)-2-methyl-1-(phenylcarbamoyl)-5-styryl-3-(2-thienyl)proline Formula: C32H27ClN2O4S MolecularWeight: 571.08578

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(N1C(=O)NC2=CC=CC=C2)C=CC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)Cl)C5=CC=CS5)C(=O)O

Isomeric SMILES

CC1(C(C(C(N1C(=O)NC2=CC=CC=C2)C=CC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)Cl)C5=CC=CS5)C(=O)O

InChI

InChI=1S/C32H27ClN2O4S/c1-32(30(37)38)28(26-16-9-19-40-26)27(29(36)22-12-8-13-23(33)20-22)25(18-17-21-10-4-2-5-11-21)35(32)31(39)34-24-14-6-3-7-15-24/h2-20,25,27-28H,1H3,(H,34,39)(H,37,38)