S-[2-(4-methyl-5-oxidanylidene-cyclohex-3-en-1-yl)propan-2-yl] ethanethioate

Systemtic Name: S-[2-(4-methyl-5-oxidanylidene-cyclohex-3-en-1-yl)propan-2-yl] ethanethioate Openeye Name: S-[1-methyl-1-(4-methyl-5-oxo-cyclohex-3-en-1-yl)ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-(4-methyl-5-oxo-1-cyclohex-3-enyl)propan-2-yl] ester IUPAC Name: S-[2-(4-methyl-5-oxocyclohex-3-en-1-yl)propan-2-yl] ethanethioate Traditional Name: ethanethioic acid S-[1-(5-keto-4-methyl-cyclohex-3-en-1-yl)-1-methyl-ethyl] ester Formula: C12H18O2S MolecularWeight: 226.33512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(CC1=O)C(C)(C)SC(=O)C

Isomeric SMILES

CC1=CCC(CC1=O)C(C)(C)SC(=O)C

InChI

InChI=1S/C12H18O2S/c1-8-5-6-10(7-11(8)14)12(3,4)15-9(2)13/h5,10H,6-7H2,1-4H3