[(1S)-2-oxidanylidenecyclohexyl] 2-(3-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 2-(3-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: [(1S)-2-oxocyclohexyl] 2-(3-chlorophenyl)-4-methyl-thiazole-5-carboxylate CAS Name: 2-(3-chlorophenyl)-4-methyl-5-thiazolecarboxylic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 2-(3-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(3-chlorophenyl)-4-methyl-thiazole-5-carboxylic acid [(1S)-2-ketocyclohexyl] ester Formula: C17H16ClNO3S MolecularWeight: 349.83184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC(=CC=C2)Cl)C(=O)OC3CCCCC3=O

Isomeric SMILES

CC1=C(SC(=N1)C2=CC(=CC=C2)Cl)C(=O)O[C@H]3CCCCC3=O

InChI

InChI=1S/C17H16ClNO3S/c1-10-15(17(21)22-14-8-3-2-7-13(14)20)23-16(19-10)11-5-4-6-12(18)9-11/h4-6,9,14H,2-3,7-8H2,1H3/t14-/m0/s1