O-ethyl [4-methyl-1-(1-methylcyclohex-2-en-1-yl)-1-oxidanylidene-pentan-3-yl]sulfanylmethanethioate

Systemtic Name: O-ethyl [4-methyl-1-(1-methylcyclohex-2-en-1-yl)-1-oxidanylidene-pentan-3-yl]sulfanylmethanethioate Openeye Name: O-ethyl [1-isopropyl-3-(1-methylcyclohex-2-en-1-yl)-3-oxo-propyl]sulfanylmethanethioate CAS Name: [[4-methyl-1-(1-methyl-1-cyclohex-2-enyl)-1-oxopentan-3-yl]thio]methanethioic acid O-ethyl ester IUPAC Name: O-ethyl [4-methyl-1-(1-methylcyclohex-2-en-1-yl)-1-oxopentan-3-yl]sulfanylmethanethioate Traditional Name: [[1-isopropyl-3-keto-3-(1-methylcyclohex-2-en-1-yl)propyl]thio]methanethioic acid O-ethyl ester Formula: C16H26O2S2 MolecularWeight: 314.50644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC(CC(=O)C1(CCCC=C1)C)C(C)C

Isomeric SMILES

CCOC(=S)SC(CC(=O)C1(CCCC=C1)C)C(C)C

InChI

InChI=1S/C16H26O2S2/c1-5-18-15(19)20-13(12(2)3)11-14(17)16(4)9-7-6-8-10-16/h7,9,12-13H,5-6,8,10-11H2,1-4H3