[2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-yl]methyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: [2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-yl]methyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate Openeye Name: [2-(4-methoxyanilino)thiazol-4-yl]methyl 4-oxo-4-(p-tolyl)butanoate CAS Name: 4-(4-methylphenyl)-4-oxobutanoic acid [2-(4-methoxyanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methoxyanilino)-1,3-thiazol-4-yl]methyl 4-(4-methylphenyl)-4-oxobutanoate Traditional Name: 4-keto-4-(p-tolyl)butyric acid [2-(p-anisidino)thiazol-4-yl]methyl ester Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=CSC(=N2)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCC(=O)OCC2=CSC(=N2)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H22N2O4S/c1-15-3-5-16(6-4-15)20(25)11-12-21(26)28-13-18-14-29-22(24-18)23-17-7-9-19(27-2)10-8-17/h3-10,14H,11-13H2,1-2H3,(H,23,24)