2-[[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethylamino]methylidene]propanedinitrile

Systemtic Name: 2-[[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethylamino]methylidene]propanedinitrile Openeye Name: 2-[[2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethylamino]methylene]propanedinitrile CAS Name: 2-[[2-[[5-(trifluoromethyl)-2-pyridinyl]thio]ethylamino]methylidene]propanedinitrile IUPAC Name: 2-[[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethylamino]methylidene]propanedinitrile Traditional Name: 2-[[2-[[5-(trifluoromethyl)-2-pyridyl]thio]ethylamino]methylene]malononitrile Formula: C12H9F3N4S MolecularWeight: 298.28687

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1C(F)(F)F)SCCNC=C(C#N)C#N

Isomeric SMILES

C1=CC(=NC=C1C(F)(F)F)SCCNC=C(C#N)C#N

InChI

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