3-(4-tert-butylphenyl)-1-[(4-fluorophenyl)carbamoyl]-5-(3-methylthiophen-2-yl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-(4-tert-butylphenyl)-1-[(4-fluorophenyl)carbamoyl]-5-(3-methylthiophen-2-yl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-tert-butylphenyl)-1-[(4-fluorophenyl)carbamoyl]-5-(3-methyl-2-thienyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(4-tert-butylphenyl)-1-[(4-fluoroanilino)-oxomethyl]-5-(3-methyl-2-thiophenyl)-4-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-tert-butylphenyl)-1-[(4-fluorophenyl)carbamoyl]-5-(3-methylthiophen-2-yl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-tert-butylphenyl)-1-[(4-fluorophenyl)carbamoyl]-5-(3-methyl-2-thienyl)-4-(2-thenoyl)proline Formula: C32H31FN2O4S2 MolecularWeight: 590.727943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(C(N2C(=O)NC3=CC=C(C=C3)F)C(=O)O)C4=CC=C(C=C4)C(C)(C)C)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=C(SC=C1)C2C(C(C(N2C(=O)NC3=CC=C(C=C3)F)C(=O)O)C4=CC=C(C=C4)C(C)(C)C)C(=O)C5=CC=CS5

InChI

InChI=1S/C32H31FN2O4S2/c1-18-15-17-41-29(18)26-25(28(36)23-6-5-16-40-23)24(19-7-9-20(10-8-19)32(2,3)4)27(30(37)38)35(26)31(39)34-22-13-11-21(33)12-14-22/h5-17,24-27H,1-4H3,(H,34,39)(H,37,38)