[2-(4-methylphenyl)-2-oxidanylidene-ethyl] 4-methyl-1,2,3-thiadiazole-5-carboxylate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 4-methyl-1,2,3-thiadiazole-5-carboxylate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 4-methylthiadiazole-5-carboxylate CAS Name: 4-methyl-5-thiadiazolecarboxylic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 4-methylthiadiazole-5-carboxylate Traditional Name: 4-methylthiadiazole-5-carboxylic acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)COC(=O)C2=C(N=NS2)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)COC(=O)C2=C(N=NS2)C

InChI

InChI=1S/C13H12N2O3S/c1-8-3-5-10(6-4-8)11(16)7-18-13(17)12-9(2)14-15-19-12/h3-6H,7H2,1-2H3