(5E)-5-[1-iodanyl-2-(phenylmethylsulfanyl)ethylidene]-4-methyl-furan-2-one

Systemtic Name: (5E)-5-[1-iodanyl-2-(phenylmethylsulfanyl)ethylidene]-4-methyl-furan-2-one Openeye Name: (5E)-5-(2-benzylsulfanyl-1-iodo-ethylidene)-4-methyl-furan-2-one CAS Name: (5E)-5-[1-iodo-2-(phenylmethylthio)ethylidene]-4-methyl-2-furanone IUPAC Name: (5E)-5-(2-benzylsulfanyl-1-iodoethylidene)-4-methylfuran-2-one Traditional Name: (5E)-5-[2-(benzylthio)-1-iodo-ethylidene]-4-methyl-furan-2-one Formula: C14H13IO2S MolecularWeight: 372.22129

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC1=C(CSCC2=CC=CC=C2)I

Isomeric SMILES

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

InChI

InChI=1S/C14H13IO2S/c1-10-7-13(16)17-14(10)12(15)9-18-8-11-5-3-2-4-6-11/h2-7H,8-9H2,1H3/b14-12+