[(2S)-1-[(4-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: [(2S)-1-[(4-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: [(1S)-2-(4-chloroanilino)-1-methyl-2-oxo-ethyl] 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-acetamido-4,5-dimethyl-3-thiophenecarboxylic acid [(2S)-1-(4-chloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-chloroanilino)-1-oxopropan-2-yl] 2-acetamido-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-acetamido-4,5-dimethyl-thiophene-3-carboxylic acid [(1S)-2-(4-chloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C18H19ClN2O4S MolecularWeight: 394.87246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC(C)C(=O)NC2=CC=C(C=C2)Cl)NC(=O)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)O[C@@H](C)C(=O)NC2=CC=C(C=C2)Cl)NC(=O)C)C

InChI

InChI=1S/C18H19ClN2O4S/c1-9-11(3)26-17(20-12(4)22)15(9)18(24)25-10(2)16(23)21-14-7-5-13(19)6-8-14/h5-8,10H,1-4H3,(H,20,22)(H,21,23)/t10-/m0/s1