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

Systemtic Name: [2-oxidanylidene-2-(4-propan-2-ylphenyl)ethyl] 4-methyl-1,2,3-thiadiazole-5-carboxylate Openeye Name: [2-(4-isopropylphenyl)-2-oxo-ethyl] 4-methylthiadiazole-5-carboxylate CAS Name: 4-methyl-5-thiadiazolecarboxylic acid [2-oxo-2-(4-propan-2-ylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-propan-2-ylphenyl)ethyl] 4-methylthiadiazole-5-carboxylate Traditional Name: 4-methylthiadiazole-5-carboxylic acid (2-keto-2-p-cumenyl-ethyl) ester Formula: C15H16N2O3S MolecularWeight: 304.36414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)OCC(=O)C2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC1=C(SN=N1)C(=O)OCC(=O)C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C15H16N2O3S/c1-9(2)11-4-6-12(7-5-11)13(18)8-20-15(19)14-10(3)16-17-21-14/h4-7,9H,8H2,1-3H3