N-[2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-1,3-benzothiazol-6-yl]methanesulfonamide

Systemtic Name: N-[2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-1,3-benzothiazol-6-yl]methanesulfonamide Openeye Name: N-[2-(4,4-difluorobut-3-enylsulfanyl)-1,3-benzothiazol-6-yl]methanesulfonamide CAS Name: N-[2-(4,4-difluorobut-3-enylthio)-1,3-benzothiazol-6-yl]methanesulfonamide IUPAC Name: N-[2-(4,4-difluorobut-3-enylsulfanyl)-1,3-benzothiazol-6-yl]methanesulfonamide Traditional Name: N-[2-(4,4-difluorobut-3-enylthio)-1,3-benzothiazol-6-yl]methanesulfonamide Formula: C12H12F2N2O2S3 MolecularWeight: 350.427686

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC2=C(C=C1)N=C(S2)SCCC=C(F)F

Isomeric SMILES

CS(=O)(=O)NC1=CC2=C(C=C1)N=C(S2)SCCC=C(F)F

InChI

InChI=1S/C12H12F2N2O2S3/c1-21(17,18)16-8-4-5-9-10(7-8)20-12(15-9)19-6-2-3-11(13)14/h3-5,7,16H,2,6H2,1H3