3-methyl-4-(phenylmethylsulfanyl)butan-2-one

Systemtic Name: 3-methyl-4-(phenylmethylsulfanyl)butan-2-one Openeye Name: 4-benzylsulfanyl-3-methyl-butan-2-one CAS Name: 3-methyl-4-(phenylmethylthio)-2-butanone IUPAC Name: 4-benzylsulfanyl-3-methylbutan-2-one Traditional Name: 4-(benzylthio)-3-methyl-butan-2-one Formula: C12H16OS MolecularWeight: 208.31984

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCC1=CC=CC=C1)C(=O)C

Isomeric SMILES

CC(CSCC1=CC=CC=C1)C(=O)C

InChI

InChI=1S/C12H16OS/c1-10(11(2)13)8-14-9-12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3