[2-(4-methylphenyl)-2-oxidanylidene-ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 2-(allylamino)thiazole-4-carboxylate CAS Name: 2-(prop-2-enylamino)-4-thiazolecarboxylic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(allylamino)thiazole-4-carboxylic acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C16H16N2O3S MolecularWeight: 316.37484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)COC(=O)C2=CSC(=N2)NCC=C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)COC(=O)C2=CSC(=N2)NCC=C

InChI

InChI=1S/C16H16N2O3S/c1-3-8-17-16-18-13(10-22-16)15(20)21-9-14(19)12-6-4-11(2)5-7-12/h3-7,10H,1,8-9H2,2H3,(H,17,18)