2-bromanyl-6-[1,1,2,2,2-pentakis(fluoranyl)ethylsulfanyl]benzenecarbonitrile

Systemtic Name: 2-bromanyl-6-[1,1,2,2,2-pentakis(fluoranyl)ethylsulfanyl]benzenecarbonitrile Openeye Name: 2-bromo-6-(1,1,2,2,2-pentafluoroethylsulfanyl)benzonitrile CAS Name: 2-bromo-6-(1,1,2,2,2-pentafluoroethylthio)benzonitrile IUPAC Name: 2-bromo-6-(1,1,2,2,2-pentafluoroethylsulfanyl)benzonitrile Traditional Name: 2-bromo-6-(1,1,2,2,2-pentafluoroethylthio)benzonitrile Formula: C9H3BrF5NS MolecularWeight: 332.087836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Br)C#N)SC(C(F)(F)F)(F)F

Isomeric SMILES

C1=CC(=C(C(=C1)Br)C#N)SC(C(F)(F)F)(F)F

InChI

InChI=1S/C9H3BrF5NS/c10-6-2-1-3-7(5(6)4-16)17-9(14,15)8(11,12)13/h1-3H