3-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpentanenitrile

Systemtic Name: 3-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpentanenitrile Openeye Name: 3-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]pentanenitrile CAS Name: 3-[[5-(trifluoromethyl)-2-pyridinyl]thio]pentanenitrile IUPAC Name: 3-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpentanenitrile Traditional Name: 3-[[5-(trifluoromethyl)-2-pyridyl]thio]valeronitrile Formula: C11H11F3N2S MolecularWeight: 260.27865

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)SC1=NC=C(C=C1)C(F)(F)F

Isomeric SMILES

CCC(CC#N)SC1=NC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C11H11F3N2S/c1-2-9(5-6-15)17-10-4-3-8(7-16-10)11(12,13)14/h3-4,7,9H,2,5H2,1H3