1-[4-(2-methylpropyl)phenyl]-2,2-bis(methylsulfanyl)ethanone

Systemtic Name: 1-[4-(2-methylpropyl)phenyl]-2,2-bis(methylsulfanyl)ethanone Openeye Name: 1-(4-isobutylphenyl)-2,2-bis(methylsulfanyl)ethanone CAS Name: 1-[4-(2-methylpropyl)phenyl]-2,2-bis(methylthio)ethanone IUPAC Name: 1-[4-(2-methylpropyl)phenyl]-2,2-bis(methylsulfanyl)ethanone Traditional Name: 1-(4-isobutylphenyl)-2,2-bis(methylthio)ethanone Formula: C14H20OS2 MolecularWeight: 268.438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(=O)C(SC)SC

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(=O)C(SC)SC

InChI

InChI=1S/C14H20OS2/c1-10(2)9-11-5-7-12(8-6-11)13(15)14(16-3)17-4/h5-8,10,14H,9H2,1-4H3