1-[(4-fluorophenyl)carbamoyl]-2-methyl-5-(3-methylphenyl)-4-(4-methylphenyl)carbonyl-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(4-fluorophenyl)carbamoyl]-2-methyl-5-(3-methylphenyl)-4-(4-methylphenyl)carbonyl-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-fluorophenyl)carbamoyl]-2-methyl-4-(4-methylbenzoyl)-5-(m-tolyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[(4-fluoroanilino)-oxomethyl]-2-methyl-5-(3-methylphenyl)-4-[(4-methylphenyl)-oxomethyl]-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-fluorophenyl)carbamoyl]-2-methyl-4-(4-methylbenzoyl)-5-(3-methylphenyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-fluorophenyl)carbamoyl]-2-methyl-5-(m-tolyl)-4-p-toluoyl-3-(2-thienyl)proline Formula: C32H29FN2O4S MolecularWeight: 556.647063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2C(C(N(C2C3=CC(=CC=C3)C)C(=O)NC4=CC=C(C=C4)F)(C)C(=O)O)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2C(C(N(C2C3=CC(=CC=C3)C)C(=O)NC4=CC=C(C=C4)F)(C)C(=O)O)C5=CC=CS5

InChI

InChI=1S/C32H29FN2O4S/c1-19-9-11-21(12-10-19)29(36)26-27(25-8-5-17-40-25)32(3,30(37)38)35(28(26)22-7-4-6-20(2)18-22)31(39)34-24-15-13-23(33)14-16-24/h4-18,26-28H,1-3H3,(H,34,39)(H,37,38)