1,3-dimethyl-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-5,6-dihydro-4H-pyrimidin-1-ium hexafluorophosphate

Systemtic Name: 1,3-dimethyl-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-5,6-dihydro-4H-pyrimidin-1-ium hexafluorophosphate Openeye Name: 1,3-dimethyl-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-5,6-dihydro-4H-pyrimidin-1-ium hexafluorophosphate CAS Name: 1,3-dimethyl-2-[(1-oxido-2-pyridin-1-iumyl)thio]-5,6-dihydro-4H-pyrimidin-1-ium hexafluorophosphate IUPAC Name: 1,3-dimethyl-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-5,6-dihydro-4H-pyrimidin-1-ium hexafluorophosphate Traditional Name: 1,3-dimethyl-2-[(1-oxidopyridin-1-ium-2-yl)thio]-5,6-dihydro-4H-pyrimidin-1-ium hexafluorophosphate Formula: C11H16F6N3OPS MolecularWeight: 383.29342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC[N+](=C1SC2=CC=CC=[N+]2[O-])C.F[P-](F)(F)(F)(F)F

Isomeric SMILES

CN1CCC[N+](=C1SC2=CC=CC=[N+]2[O-])C.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C11H16N3OS.F6P/c1-12-7-5-8-13(2)11(12)16-10-6-3-4-9-14(10)15;1-7(2,3,4,5)6/h3-4,6,9H,5,7-8H2,1-2H3;/q+1;-1