3,5-dicyano-4-methyl-6-sulfanyl-3,4-dihydropyridin-2-olate; 4-methylmorpholin-4-ium

Systemtic Name: 3,5-dicyano-4-methyl-6-sulfanyl-3,4-dihydropyridin-2-olate; 4-methylmorpholin-4-ium Openeye Name: 3,5-dicyano-4-methyl-6-sulfanyl-3,4-dihydropyridin-2-olate; 4-methylmorpholin-4-ium CAS Name: 3,5-dicyano-6-mercapto-4-methyl-3,4-dihydropyridin-2-olate; 4-methylmorpholin-4-ium IUPAC Name: 3,5-dicyano-4-methyl-6-sulfanyl-3,4-dihydropyridin-2-olate; 4-methylmorpholin-4-ium Traditional Name: 3,5-dicyano-6-mercapto-4-methyl-3,4-dihydropyridin-2-olate; 4-methylmorpholin-4-ium Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=NC(=C1C#N)S)[O-])C#N.C[NH+]1CCOCC1

Isomeric SMILES

CC1C(C(=NC(=C1C#N)S)[O-])C#N.C[NH+]1CCOCC1

InChI

InChI=1S/C8H7N3OS.C5H11NO/c1-4-5(2-9)7(12)11-8(13)6(4)3-10;1-6-2-4-7-5-3-6/h4-5,13H,1H3,(H,11,12);2-5H2,1H3