1-[1,1-bis(oxidanylidene)-4-phenylsulfanyl-2,5-dihydrothiophen-3-yl]propan-1-one

Systemtic Name: 1-[1,1-bis(oxidanylidene)-4-phenylsulfanyl-2,5-dihydrothiophen-3-yl]propan-1-one Openeye Name: 1-(1,1-dioxo-4-phenylsulfanyl-2,5-dihydrothiophen-3-yl)propan-1-one CAS Name: 1-[1,1-dioxo-4-(phenylthio)-2,5-dihydrothiophen-3-yl]-1-propanone IUPAC Name: 1-(1,1-dioxo-4-phenylsulfanyl-2,5-dihydrothiophen-3-yl)propan-1-one Traditional Name: 1-[1,1-diketo-4-(phenylthio)-2,5-dihydrothiophen-3-yl]propan-1-one Formula: C13H14O3S2 MolecularWeight: 282.37846

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(CS(=O)(=O)C1)SC2=CC=CC=C2

Isomeric SMILES

CCC(=O)C1=C(CS(=O)(=O)C1)SC2=CC=CC=C2

InChI

InChI=1S/C13H14O3S2/c1-2-12(14)11-8-18(15,16)9-13(11)17-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3