[(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 2-(3-chlorophenyl)-1,3-thiazole-4-carboxylate

Systemtic Name: [(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 2-(3-chlorophenyl)-1,3-thiazole-4-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-(p-tolyl)ethyl] 2-(3-chlorophenyl)thiazole-4-carboxylate CAS Name: 2-(3-chlorophenyl)-4-thiazolecarboxylic acid [(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl] 2-(3-chlorophenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(3-chlorophenyl)thiazole-4-carboxylic acid [(1S)-2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C20H16ClNO3S MolecularWeight: 385.86394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CSC(=N2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)C2=CSC(=N2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H16ClNO3S/c1-12-6-8-14(9-7-12)18(23)13(2)25-20(24)17-11-26-19(22-17)15-4-3-5-16(21)10-15/h3-11,13H,1-2H3/t13-/m0/s1