1-(4-methylphenyl)carbonyl-2-(2-methylpropyl)-5-(1,3-thiazol-2-yl)pyrrolidine-2,4-dicarboxylic acid

Systemtic Name: 1-(4-methylphenyl)carbonyl-2-(2-methylpropyl)-5-(1,3-thiazol-2-yl)pyrrolidine-2,4-dicarboxylic acid Openeye Name: 2-isobutyl-1-(4-methylbenzoyl)-5-thiazol-2-yl-pyrrolidine-2,4-dicarboxylic acid CAS Name: 1-[(4-methylphenyl)-oxomethyl]-2-(2-methylpropyl)-5-(2-thiazolyl)pyrrolidine-2,4-dicarboxylic acid IUPAC Name: 1-(4-methylbenzoyl)-2-(2-methylpropyl)-5-(1,3-thiazol-2-yl)pyrrolidine-2,4-dicarboxylic acid Traditional Name: 2-isobutyl-1-p-toluoyl-5-thiazol-2-yl-pyrrolidine-2,4-dicarboxylic acid Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(C(CC2(CC(C)C)C(=O)O)C(=O)O)C3=NC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C(C(CC2(CC(C)C)C(=O)O)C(=O)O)C3=NC=CS3

InChI

InChI=1S/C21H24N2O5S/c1-12(2)10-21(20(27)28)11-15(19(25)26)16(17-22-8-9-29-17)23(21)18(24)14-6-4-13(3)5-7-14/h4-9,12,15-16H,10-11H2,1-3H3,(H,25,26)(H,27,28)