[1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-(4-methylphenyl)thiophene-2-carboxylate

Systemtic Name: [1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-(4-methylphenyl)thiophene-2-carboxylate Openeye Name: [2-(allylamino)-1-methyl-2-oxo-ethyl] 3-(p-tolyl)thiophene-2-carboxylate CAS Name: 3-(4-methylphenyl)-2-thiophenecarboxylic acid [1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(prop-2-enylamino)propan-2-yl] 3-(4-methylphenyl)thiophene-2-carboxylate Traditional Name: 3-(p-tolyl)thiophene-2-carboxylic acid [2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H19NO3S MolecularWeight: 329.41336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC=C2)C(=O)OC(C)C(=O)NCC=C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC=C2)C(=O)OC(C)C(=O)NCC=C

InChI

InChI=1S/C18H19NO3S/c1-4-10-19-17(20)13(3)22-18(21)16-15(9-11-23-16)14-7-5-12(2)6-8-14/h4-9,11,13H,1,10H2,2-3H3,(H,19,20)