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

Systemtic Name: 4-fluoranyl-3-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-fluoro-3-[[5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]benzonitrile CAS Name: 4-fluoro-3-[[[5-(trifluoromethyl)-2-pyridinyl]thio]methyl]benzonitrile IUPAC Name: 4-fluoro-3-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 4-fluoro-3-[[[5-(trifluoromethyl)-2-pyridyl]thio]methyl]benzonitrile Formula: C14H8F4N2S MolecularWeight: 312.285333

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)CSC2=NC=C(C=C2)C(F)(F)F)F

Isomeric SMILES

C1=CC(=C(C=C1C#N)CSC2=NC=C(C=C2)C(F)(F)F)F

InChI

InChI=1S/C14H8F4N2S/c15-12-3-1-9(6-19)5-10(12)8-21-13-4-2-11(7-20-13)14(16,17)18/h1-5,7H,8H2