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

Systemtic Name: 4-(3-chlorophenyl)carbonyl-1-(phenylcarbamoyl)-5-(2-phenylethenyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(3-chlorobenzoyl)-1-(phenylcarbamoyl)-5-styryl-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[anilino(oxo)methyl]-4-[(3-chlorophenyl)-oxomethyl]-5-(2-phenylethenyl)-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(3-chlorobenzoyl)-1-(phenylcarbamoyl)-5-(2-phenylethenyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(3-chlorobenzoyl)-1-(phenylcarbamoyl)-5-styryl-3-(2-thienyl)proline Formula: C31H25ClN2O4S MolecularWeight: 557.0592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC2C(C(C(N2C(=O)NC3=CC=CC=C3)C(=O)O)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)C=CC2C(C(C(N2C(=O)NC3=CC=CC=C3)C(=O)O)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C31H25ClN2O4S/c32-22-12-7-11-21(19-22)29(35)26-24(17-16-20-9-3-1-4-10-20)34(31(38)33-23-13-5-2-6-14-23)28(30(36)37)27(26)25-15-8-18-39-25/h1-19,24,26-28H,(H,33,38)(H,36,37)