2-[3,4,4-tris(fluoranyl)but-3-enylsulfanyl]-4,5-dihydro-1H-imidazol-1-ium bromide

Systemtic Name: 2-[3,4,4-tris(fluoranyl)but-3-enylsulfanyl]-4,5-dihydro-1H-imidazol-1-ium bromide Openeye Name: 2-(3,4,4-trifluorobut-3-enylsulfanyl)-4,5-dihydro-1H-imidazol-1-ium bromide CAS Name: 2-(3,4,4-trifluorobut-3-enylthio)-4,5-dihydro-1H-imidazol-1-ium bromide IUPAC Name: 2-(3,4,4-trifluorobut-3-enylsulfanyl)-4,5-dihydro-1H-imidazol-1-ium bromide Traditional Name: 2-(3,4,4-trifluorobut-3-enylthio)-2-imidazolin-1-ium bromide Formula: C7H10BrF3N2S MolecularWeight: 291.13191

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C([NH2+]1)SCCC(=C(F)F)F.[Br-]

Isomeric SMILES

C1CN=C([NH2+]1)SCCC(=C(F)F)F.[Br-]

InChI

InChI=1S/C7H9F3N2S.BrH/c8-5(6(9)10)1-4-13-7-11-2-3-12-7;/h1-4H2,(H,11,12);1H