1-[(3-methylphenyl)carbamoyl]-4-(2-methylphenyl)carbonyl-3,5-bis(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-methylphenyl)carbamoyl]-4-(2-methylphenyl)carbonyl-3,5-bis(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Openeye Name: 4-(2-methylbenzoyl)-3,5-bis(3-methyl-2-thienyl)-1-(m-tolylcarbamoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-methylanilino)-oxomethyl]-4-[(2-methylphenyl)-oxomethyl]-3,5-bis(3-methyl-2-thiophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(2-methylbenzoyl)-1-[(3-methylphenyl)carbamoyl]-3,5-bis(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Traditional Name: 3,5-bis(3-methyl-2-thienyl)-1-(m-tolylcarbamoyl)-4-o-toluoyl-proline Formula: C31H30N2O4S2 MolecularWeight: 558.7109

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2C(C(C(C2C(=O)O)C3=C(C=CS3)C)C(=O)C4=CC=CC=C4C)C5=C(C=CS5)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2C(C(C(C2C(=O)O)C3=C(C=CS3)C)C(=O)C4=CC=CC=C4C)C5=C(C=CS5)C

InChI

InChI=1S/C31H30N2O4S2/c1-17-8-7-10-21(16-17)32-31(37)33-25(29-20(4)13-15-39-29)23(27(34)22-11-6-5-9-18(22)2)24(26(33)30(35)36)28-19(3)12-14-38-28/h5-16,23-26H,1-4H3,(H,32,37)(H,35,36)