5,5-dimethyl-4-(4-methylsulfanylphenyl)furan-2-one

Systemtic Name: 5,5-dimethyl-4-(4-methylsulfanylphenyl)furan-2-one Openeye Name: 5,5-dimethyl-4-(4-methylsulfanylphenyl)furan-2-one CAS Name: 5,5-dimethyl-4-[4-(methylthio)phenyl]-2-furanone IUPAC Name: 5,5-dimethyl-4-(4-methylsulfanylphenyl)furan-2-one Traditional Name: 5,5-dimethyl-4-[4-(methylthio)phenyl]furan-2-one Formula: C13H14O2S MolecularWeight: 234.31406

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=CC(=O)O1)C2=CC=C(C=C2)SC)C

Isomeric SMILES

CC1(C(=CC(=O)O1)C2=CC=C(C=C2)SC)C

InChI

InChI=1S/C13H14O2S/c1-13(2)11(8-12(14)15-13)9-4-6-10(16-3)7-5-9/h4-8H,1-3H3