4-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbutanenitrile

Systemtic Name: 4-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbutanenitrile Openeye Name: 4-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]butanenitrile CAS Name: 4-[[5-(trifluoromethyl)-2-pyridinyl]thio]butanenitrile IUPAC Name: 4-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[5-(trifluoromethyl)-2-pyridyl]thio]butyronitrile Formula: C10H9F3N2S MolecularWeight: 246.25207

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1C(F)(F)F)SCCCC#N

Isomeric SMILES

C1=CC(=NC=C1C(F)(F)F)SCCCC#N

InChI

InChI=1S/C10H9F3N2S/c11-10(12,13)8-3-4-9(15-7-8)16-6-2-1-5-14/h3-4,7H,1-2,6H2