3-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[[5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]benzonitrile CAS Name: 3-[[[5-(trifluoromethyl)-2-pyridinyl]thio]methyl]benzonitrile IUPAC Name: 3-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 3-[[[5-(trifluoromethyl)-2-pyridyl]thio]methyl]benzonitrile Formula: C14H9F3N2S MolecularWeight: 294.29487

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSC2=NC=C(C=C2)C(F)(F)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CSC2=NC=C(C=C2)C(F)(F)F)C#N

InChI

InChI=1S/C14H9F3N2S/c15-14(16,17)12-4-5-13(19-8-12)20-9-11-3-1-2-10(6-11)7-18/h1-6,8H,9H2