(5Z)-4-methyl-5-[(E)-4-phenyl-1-(phenylmethylsulfanyl)but-3-en-2-ylidene]furan-2-one

Systemtic Name: (5Z)-4-methyl-5-[(E)-4-phenyl-1-(phenylmethylsulfanyl)but-3-en-2-ylidene]furan-2-one Openeye Name: (5Z)-5-[(E)-1-(benzylsulfanylmethyl)-3-phenyl-prop-2-enylidene]-4-methyl-furan-2-one CAS Name: (5Z)-4-methyl-5-[(E)-4-phenyl-1-(phenylmethylthio)but-3-en-2-ylidene]-2-furanone IUPAC Name: (5Z)-5-[(E)-1-benzylsulfanyl-4-phenylbut-3-en-2-ylidene]-4-methylfuran-2-one Traditional Name: (5Z)-5-[(E)-1-[(benzylthio)methyl]-3-phenyl-prop-2-enylidene]-4-methyl-furan-2-one Formula: C22H20O2S MolecularWeight: 348.458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC1=C(CSCC2=CC=CC=C2)C=CC3=CC=CC=C3

Isomeric SMILES

CC\1=CC(=O)O/C1=C(\CSCC2=CC=CC=C2)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H20O2S/c1-17-14-21(23)24-22(17)20(13-12-18-8-4-2-5-9-18)16-25-15-19-10-6-3-7-11-19/h2-14H,15-16H2,1H3/b13-12+,22-20-