3-[2-[bis(methylsulfanyl)methylidene]butyl]cyclohexan-1-one

Systemtic Name: 3-[2-[bis(methylsulfanyl)methylidene]butyl]cyclohexan-1-one Openeye Name: 3-[2-[bis(methylsulfanyl)methylene]butyl]cyclohexanone CAS Name: 3-[2-[bis(methylthio)methylidene]butyl]-1-cyclohexanone IUPAC Name: 3-[2-[bis(methylsulfanyl)methylidene]butyl]cyclohexan-1-one Traditional Name: 3-[2-ethyl-3,3-bis(methylthio)allyl]cyclohexanone Formula: C13H22OS2 MolecularWeight: 258.44318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(SC)SC)CC1CCCC(=O)C1

Isomeric SMILES

CCC(=C(SC)SC)CC1CCCC(=O)C1

InChI

InChI=1S/C13H22OS2/c1-4-11(13(15-2)16-3)8-10-6-5-7-12(14)9-10/h10H,4-9H2,1-3H3