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

Systemtic Name: 2-methyl-5-(3-methylphenyl)-1-[(3-methylphenyl)carbamoyl]-4-(4-methylphenyl)carbonyl-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 2-methyl-4-(4-methylbenzoyl)-5-(m-tolyl)-1-(m-tolylcarbamoyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 2-methyl-1-[(3-methylanilino)-oxomethyl]-5-(3-methylphenyl)-4-[(4-methylphenyl)-oxomethyl]-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 2-methyl-4-(4-methylbenzoyl)-5-(3-methylphenyl)-1-[(3-methylphenyl)carbamoyl]-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 2-methyl-5-(m-tolyl)-1-(m-tolylcarbamoyl)-4-p-toluoyl-3-(2-thienyl)proline Formula: C33H32N2O4S MolecularWeight: 552.68318

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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=CC(=C4)C)(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=CC(=C4)C)(C)C(=O)O)C5=CC=CS5

InChI

InChI=1S/C33H32N2O4S/c1-20-13-15-23(16-14-20)30(36)27-28(26-12-7-17-40-26)33(4,31(37)38)35(29(27)24-10-5-8-21(2)18-24)32(39)34-25-11-6-9-22(3)19-25/h5-19,27-29H,1-4H3,(H,34,39)(H,37,38)