[(1S)-2-oxidanylidenecyclohexyl] 2-(4-ethylphenyl)-1,3-thiazole-4-carboxylate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 2-(4-ethylphenyl)-1,3-thiazole-4-carboxylate Openeye Name: [(1S)-2-oxocyclohexyl] 2-(4-ethylphenyl)thiazole-4-carboxylate CAS Name: 2-(4-ethylphenyl)-4-thiazolecarboxylic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 2-(4-ethylphenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(4-ethylphenyl)thiazole-4-carboxylic acid [(1S)-2-ketocyclohexyl] ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)C(=O)OC3CCCCC3=O

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)C(=O)O[C@H]3CCCCC3=O

InChI

InChI=1S/C18H19NO3S/c1-2-12-7-9-13(10-8-12)17-19-14(11-23-17)18(21)22-16-6-4-3-5-15(16)20/h7-11,16H,2-6H2,1H3/t16-/m0/s1