3-methylsulfanyl-1-phenyl-butane-1,2-dione

Systemtic Name: 3-methylsulfanyl-1-phenyl-butane-1,2-dione Openeye Name: 3-methylsulfanyl-1-phenyl-butane-1,2-dione CAS Name: 3-(methylthio)-1-phenylbutane-1,2-dione IUPAC Name: 3-methylsulfanyl-1-phenylbutane-1,2-dione Traditional Name: 3-(methylthio)-1-phenyl-butane-1,2-dione Formula: C11H12O2S MolecularWeight: 208.27678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12O2S/c1-8(14-2)10(12)11(13)9-6-4-3-5-7-9/h3-8H,1-2H3