1-[2,5-bis(fluoranyl)phenyl]-2-butan-2-ylsulfanyl-ethanone

Systemtic Name: 1-[2,5-bis(fluoranyl)phenyl]-2-butan-2-ylsulfanyl-ethanone Openeye Name: 1-(2,5-difluorophenyl)-2-sec-butylsulfanyl-ethanone CAS Name: 2-(butan-2-ylthio)-1-(2,5-difluorophenyl)ethanone IUPAC Name: 2-butan-2-ylsulfanyl-1-(2,5-difluorophenyl)ethanone Traditional Name: 1-(2,5-difluorophenyl)-2-(sec-butylthio)ethanone Formula: C12H14F2OS MolecularWeight: 244.300766

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SCC(=O)C1=C(C=CC(=C1)F)F

Isomeric SMILES

CCC(C)SCC(=O)C1=C(C=CC(=C1)F)F

InChI

InChI=1S/C12H14F2OS/c1-3-8(2)16-7-12(15)10-6-9(13)4-5-11(10)14/h4-6,8H,3,7H2,1-2H3