1-[2,5-bis(fluoranyl)phenyl]-2-tert-butylsulfanyl-ethanone

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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