(3Z)-1-cyclohexyl-3-[ethylsulfanyl(oxidanyl)methylidene]-5-methyl-1-sulfanyl-hexane-2,4-dione

Systemtic Name: (3Z)-1-cyclohexyl-3-[ethylsulfanyl(oxidanyl)methylidene]-5-methyl-1-sulfanyl-hexane-2,4-dione Openeye Name: (3Z)-1-cyclohexyl-3-[ethylsulfanyl(hydroxy)methylene]-5-methyl-1-sulfanyl-hexane-2,4-dione CAS Name: (3Z)-1-cyclohexyl-3-[(ethylthio)-hydroxymethylidene]-1-mercapto-5-methylhexane-2,4-dione IUPAC Name: (3Z)-1-cyclohexyl-3-[ethylsulfanyl(hydroxy)methylidene]-5-methyl-1-sulfanylhexane-2,4-dione Traditional Name: (3Z)-1-cyclohexyl-3-[(ethylthio)-hydroxy-methylene]-1-mercapto-5-methyl-hexane-2,4-dione Formula: C16H26O3S2 MolecularWeight: 330.50584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(=C(C(=O)C(C)C)C(=O)C(C1CCCCC1)S)O

Isomeric SMILES

CCS/C(=C(/C(=O)C(C)C)\C(=O)C(C1CCCCC1)S)/O

InChI

InChI=1S/C16H26O3S2/c1-4-21-16(19)12(13(17)10(2)3)14(18)15(20)11-8-6-5-7-9-11/h10-11,15,19-20H,4-9H2,1-3H3/b16-12-