(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-(4-methylphenyl)-4-oxidanylidene-butanoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 4-oxo-4-(p-tolyl)butanoate CAS Name: 4-(4-methylphenyl)-4-oxobutanoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-(4-methylphenyl)-4-oxobutanoate Traditional Name: 4-keto-4-(p-tolyl)butyric acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C19H17NO3S2 MolecularWeight: 371.47318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17NO3S2/c1-13-2-4-14(5-3-13)17(21)6-7-18(22)23-10-16-12-25-19(20-16)15-8-9-24-11-15/h2-5,8-9,11-12H,6-7,10H2,1H3