2-[5-methyl-2-(trifluoromethylsulfanyl)phenyl]ethanenitrile

Systemtic Name: 2-[5-methyl-2-(trifluoromethylsulfanyl)phenyl]ethanenitrile Openeye Name: 2-[5-methyl-2-(trifluoromethylsulfanyl)phenyl]acetonitrile CAS Name: 2-[5-methyl-2-(trifluoromethylthio)phenyl]acetonitrile IUPAC Name: 2-[5-methyl-2-(trifluoromethylsulfanyl)phenyl]acetonitrile Traditional Name: 2-[5-methyl-2-(trifluoromethylthio)phenyl]acetonitrile Formula: C10H8F3NS MolecularWeight: 231.23743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC(F)(F)F)CC#N

Isomeric SMILES

CC1=CC(=C(C=C1)SC(F)(F)F)CC#N

InChI

InChI=1S/C10H8F3NS/c1-7-2-3-9(15-10(11,12)13)8(6-7)4-5-14/h2-3,6H,4H2,1H3