5-cyano-6-sulfanylidene-4-(trifluoromethyl)-1H-pyridin-2-olate; 4-methylmorpholin-4-ium

Systemtic Name: 5-cyano-6-sulfanylidene-4-(trifluoromethyl)-1H-pyridin-2-olate; 4-methylmorpholin-4-ium Openeye Name: 5-cyano-6-thioxo-4-(trifluoromethyl)-1H-pyridin-2-olate; 4-methylmorpholin-4-ium CAS Name: 5-cyano-6-sulfanylidene-4-(trifluoromethyl)-1H-pyridin-2-olate; 4-methylmorpholin-4-ium IUPAC Name: 5-cyano-6-sulfanylidene-4-(trifluoromethyl)-1H-pyridin-2-olate; 4-methylmorpholin-4-ium Traditional Name: 5-cyano-6-thioxo-4-(trifluoromethyl)-1H-pyridin-2-olate; 4-methylmorpholin-4-ium Formula: C12H14F3N3O2S MolecularWeight: 321.31867

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCOCC1.C1=C(NC(=S)C(=C1C(F)(F)F)C#N)[O-]

Isomeric SMILES

C[NH+]1CCOCC1.C1=C(NC(=S)C(=C1C(F)(F)F)C#N)[O-]

InChI

InChI=1S/C7H3F3N2OS.C5H11NO/c8-7(9,10)4-1-5(13)12-6(14)3(4)2-11;1-6-2-4-7-5-3-6/h1H,(H2,12,13,14);2-5H2,1H3