[2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl] 2-(3-chlorophenyl)-1,3-thiazole-4-carboxylate

Systemtic Name: [2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl] 2-(3-chlorophenyl)-1,3-thiazole-4-carboxylate Openeye Name: [2-(2,4-dimethylphenyl)-2-oxo-ethyl] 2-(3-chlorophenyl)thiazole-4-carboxylate CAS Name: 2-(3-chlorophenyl)-4-thiazolecarboxylic acid [2-(2,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethylphenyl)-2-oxoethyl] 2-(3-chlorophenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(3-chlorophenyl)thiazole-4-carboxylic acid [2-(2,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C20H16ClNO3S MolecularWeight: 385.86394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16ClNO3S/c1-12-6-7-16(13(2)8-12)18(23)10-25-20(24)17-11-26-19(22-17)14-4-3-5-15(21)9-14/h3-9,11H,10H2,1-2H3