2-[4-(trifluoromethylsulfanyl)phenyl]ethanenitrile

Systemtic Name: 2-[4-(trifluoromethylsulfanyl)phenyl]ethanenitrile Openeye Name: 2-[4-(trifluoromethylsulfanyl)phenyl]acetonitrile CAS Name: 2-[4-(trifluoromethylthio)phenyl]acetonitrile IUPAC Name: 2-[4-(trifluoromethylsulfanyl)phenyl]acetonitrile Traditional Name: 2-[4-(trifluoromethylthio)phenyl]acetonitrile Formula: C9H6F3NS MolecularWeight: 217.21085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)SC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CC#N)SC(F)(F)F

InChI

InChI=1S/C9H6F3NS/c10-9(11,12)14-8-3-1-7(2-4-8)5-6-13/h1-4H,5H2