2-(propan-2-ylamino)-2-[4-(trifluoromethylsulfanyl)phenyl]ethanenitrile

Systemtic Name: 2-(propan-2-ylamino)-2-[4-(trifluoromethylsulfanyl)phenyl]ethanenitrile Openeye Name: 2-(isopropylamino)-2-[4-(trifluoromethylsulfanyl)phenyl]acetonitrile CAS Name: 2-(propan-2-ylamino)-2-[4-(trifluoromethylthio)phenyl]acetonitrile IUPAC Name: 2-(propan-2-ylamino)-2-[4-(trifluoromethylsulfanyl)phenyl]acetonitrile Traditional Name: 2-(isopropylamino)-2-[4-(trifluoromethylthio)phenyl]acetonitrile Formula: C12H13F3N2S MolecularWeight: 274.30523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13F3N2S/c1-8(2)17-11(7-16)9-3-5-10(6-4-9)18-12(13,14)15/h3-6,8,11,17H,1-2H3