2-[[2-[3-(trifluoromethyl)pyridin-2-yl]sulfanylethylamino]methylidene]propanedinitrile

Systemtic Name: 2-[[2-[3-(trifluoromethyl)pyridin-2-yl]sulfanylethylamino]methylidene]propanedinitrile Openeye Name: 2-[[2-[[3-(trifluoromethyl)-2-pyridyl]sulfanyl]ethylamino]methylene]propanedinitrile CAS Name: 2-[[2-[[3-(trifluoromethyl)-2-pyridinyl]thio]ethylamino]methylidene]propanedinitrile IUPAC Name: 2-[[2-[3-(trifluoromethyl)pyridin-2-yl]sulfanylethylamino]methylidene]propanedinitrile Traditional Name: 2-[[2-[[3-(trifluoromethyl)-2-pyridyl]thio]ethylamino]methylene]malononitrile Formula: C12H9F3N4S MolecularWeight: 298.28687

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCCNC=C(C#N)C#N)C(F)(F)F

Isomeric SMILES

C1=CC(=C(N=C1)SCCNC=C(C#N)C#N)C(F)(F)F

InChI

InChI=1S/C12H9F3N4S/c13-12(14,15)10-2-1-3-19-11(10)20-5-4-18-8-9(6-16)7-17/h1-3,8,18H,4-5H2