3-methyl-4-(2-methyl-3-oxidanylidene-butyl)sulfanyl-butan-2-one

Systemtic Name: 3-methyl-4-(2-methyl-3-oxidanylidene-butyl)sulfanyl-butan-2-one Openeye Name: 3-methyl-4-(2-methyl-3-oxo-butyl)sulfanyl-butan-2-one CAS Name: 3-methyl-4-[(2-methyl-3-oxobutyl)thio]-2-butanone IUPAC Name: 3-methyl-4-(2-methyl-3-oxobutyl)sulfanylbutan-2-one Traditional Name: 4-[(3-keto-2-methyl-butyl)thio]-3-methyl-butan-2-one Formula: C10H18O2S MolecularWeight: 202.31372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CSCC(C)C(=O)C)C(=O)C

Isomeric SMILES

CC(CSCC(C)C(=O)C)C(=O)C

InChI

InChI=1S/C10H18O2S/c1-7(9(3)11)5-13-6-8(2)10(4)12/h7-8H,5-6H2,1-4H3