2-(2-methylphenoxy)-2-[2-(4-methylphenyl)-4-propan-2-yl-1,3-thiazol-5-yl]-3-oxidanylidene-pentanoic acid

Systemtic Name: 2-(2-methylphenoxy)-2-[2-(4-methylphenyl)-4-propan-2-yl-1,3-thiazol-5-yl]-3-oxidanylidene-pentanoic acid Openeye Name: 2-[4-isopropyl-2-(p-tolyl)thiazol-5-yl]-2-(2-methylphenoxy)-3-oxo-pentanoic acid CAS Name: 2-(2-methylphenoxy)-2-[2-(4-methylphenyl)-4-propan-2-yl-5-thiazolyl]-3-oxopentanoic acid IUPAC Name: 2-(2-methylphenoxy)-2-[2-(4-methylphenyl)-4-propan-2-yl-1,3-thiazol-5-yl]-3-oxopentanoic acid Traditional Name: 2-[4-isopropyl-2-(p-tolyl)thiazol-5-yl]-3-keto-2-(2-methylphenoxy)valeric acid Formula: C25H27NO4S MolecularWeight: 437.55118

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C1=C(N=C(S1)C2=CC=C(C=C2)C)C(C)C)(C(=O)O)OC3=CC=CC=C3C

Isomeric SMILES

CCC(=O)C(C1=C(N=C(S1)C2=CC=C(C=C2)C)C(C)C)(C(=O)O)OC3=CC=CC=C3C

InChI

InChI=1S/C25H27NO4S/c1-6-20(27)25(24(28)29,30-19-10-8-7-9-17(19)5)22-21(15(2)3)26-23(31-22)18-13-11-16(4)12-14-18/h7-15H,6H2,1-5H3,(H,28,29)