4,5,5-trimethyl-3-phenylsulfanyl-furan-2-one

Systemtic Name: 4,5,5-trimethyl-3-phenylsulfanyl-furan-2-one Openeye Name: 4,5,5-trimethyl-3-phenylsulfanyl-furan-2-one CAS Name: 4,5,5-trimethyl-3-(phenylthio)-2-furanone IUPAC Name: 4,5,5-trimethyl-3-phenylsulfanylfuran-2-one Traditional Name: 4,5,5-trimethyl-3-(phenylthio)furan-2-one Formula: C13H14O2S MolecularWeight: 234.31406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC1(C)C)SC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=O)OC1(C)C)SC2=CC=CC=C2

InChI

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