2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-5-methylsulfonyl-1,3-benzothiazole

Systemtic Name: 2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-5-methylsulfonyl-1,3-benzothiazole Openeye Name: 2-(4,4-difluorobut-3-enylsulfanyl)-5-methylsulfonyl-1,3-benzothiazole CAS Name: 2-(4,4-difluorobut-3-enylthio)-5-methylsulfonyl-1,3-benzothiazole IUPAC Name: 2-(4,4-difluorobut-3-enylsulfanyl)-5-methylsulfonyl-1,3-benzothiazole Traditional Name: 2-(4,4-difluorobut-3-enylthio)-5-mesyl-1,3-benzothiazole Formula: C12H11F2NO2S3 MolecularWeight: 335.413046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)SC(=N2)SCCC=C(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)SC(=N2)SCCC=C(F)F

InChI

InChI=1S/C12H11F2NO2S3/c1-20(16,17)8-4-5-10-9(7-8)15-12(19-10)18-6-2-3-11(13)14/h3-5,7H,2,6H2,1H3