2-[3,4,4-tris(fluoranyl)but-3-enylsulfanyl]pyrimidin-4-olate

Systemtic Name: 2-[3,4,4-tris(fluoranyl)but-3-enylsulfanyl]pyrimidin-4-olate Openeye Name: 2-(3,4,4-trifluorobut-3-enylsulfanyl)pyrimidin-4-olate CAS Name: 2-(3,4,4-trifluorobut-3-enylthio)-4-pyrimidinolate IUPAC Name: 2-(3,4,4-trifluorobut-3-enylsulfanyl)pyrimidin-4-olate Traditional Name: 2-(3,4,4-trifluorobut-3-enylthio)pyrimidin-4-olate Formula: C8H6F3N2OS- MolecularWeight: 235.20625

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1[O-])SCCC(=C(F)F)F

Isomeric SMILES

C1=CN=C(N=C1[O-])SCCC(=C(F)F)F

InChI

InChI=1S/C8H7F3N2OS/c9-5(7(10)11)2-4-15-8-12-3-1-6(14)13-8/h1,3H,2,4H2,(H,12,13,14)/p-1