4-(3-chlorophenyl)carbonyl-5-(4-cyanophenyl)-3-thiophen-2-yl-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(3-chlorophenyl)carbonyl-5-(4-cyanophenyl)-3-thiophen-2-yl-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(3-chlorobenzoyl)-5-(4-cyanophenyl)-3-(2-thienyl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 4-[(3-chlorophenyl)-oxomethyl]-5-(4-cyanophenyl)-1-[oxo(thiophen-2-yl)methyl]-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(3-chlorobenzoyl)-5-(4-cyanophenyl)-1-(thiophene-2-carbonyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(3-chlorobenzoyl)-5-(4-cyanophenyl)-1-(2-thenoyl)-3-(2-thienyl)proline Formula: C28H19ClN2O4S2 MolecularWeight: 547.04446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(=O)C2C(C(N(C2C3=CC=C(C=C3)C#N)C(=O)C4=CC=CS4)C(=O)O)C5=CC=CS5

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(=O)C2C(C(N(C2C3=CC=C(C=C3)C#N)C(=O)C4=CC=CS4)C(=O)O)C5=CC=CS5

InChI

InChI=1S/C28H19ClN2O4S2/c29-19-5-1-4-18(14-19)26(32)23-22(20-6-2-12-36-20)25(28(34)35)31(27(33)21-7-3-13-37-21)24(23)17-10-8-16(15-30)9-11-17/h1-14,22-25H,(H,34,35)