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

Systemtic Name: 4-(3-chlorophenyl)carbonyl-5-(4-cyanophenyl)-2-methyl-3-thiophen-2-yl-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(3-chlorobenzoyl)-5-(4-cyanophenyl)-2-methyl-3-(2-thienyl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 4-[(3-chlorophenyl)-oxomethyl]-5-(4-cyanophenyl)-2-methyl-1-[oxo(thiophen-2-yl)methyl]-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(3-chlorobenzoyl)-5-(4-cyanophenyl)-2-methyl-1-(thiophene-2-carbonyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-(3-chlorobenzoyl)-5-(4-cyanophenyl)-2-methyl-1-(2-thenoyl)-3-(2-thienyl)proline Formula: C29H21ClN2O4S2 MolecularWeight: 561.07104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(N1C(=O)C2=CC=CS2)C3=CC=C(C=C3)C#N)C(=O)C4=CC(=CC=C4)Cl)C5=CC=CS5)C(=O)O

Isomeric SMILES

CC1(C(C(C(N1C(=O)C2=CC=CS2)C3=CC=C(C=C3)C#N)C(=O)C4=CC(=CC=C4)Cl)C5=CC=CS5)C(=O)O

InChI

InChI=1S/C29H21ClN2O4S2/c1-29(28(35)36)24(21-7-3-13-37-21)23(26(33)19-5-2-6-20(30)15-19)25(18-11-9-17(16-31)10-12-18)32(29)27(34)22-8-4-14-38-22/h2-15,23-25H,1H3,(H,35,36)