6-azanyl-3,5-dicyano-4-pyridin-3-yl-1,4-dihydropyridine-2-thiolate; morpholin-4-ium

Systemtic Name: 6-azanyl-3,5-dicyano-4-pyridin-3-yl-1,4-dihydropyridine-2-thiolate; morpholin-4-ium Openeye Name: 6-amino-3,5-dicyano-4-(3-pyridyl)-1,4-dihydropyridine-2-thiolate; morpholin-4-ium CAS Name: 6-amino-3,5-dicyano-4-(3-pyridinyl)-1,4-dihydropyridine-2-thiolate; morpholin-4-ium IUPAC Name: 6-amino-3,5-dicyano-4-pyridin-3-yl-1,4-dihydropyridine-2-thiolate; morpholin-4-ium Traditional Name: 6-amino-3,5-dicyano-4-(3-pyridyl)-1,4-dihydropyridine-2-thiolate; morpholin-4-ium Formula: C16H18N6OS MolecularWeight: 342.41872

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH2+]1.C1=CC(=CN=C1)C2C(=C(NC(=C2C#N)[S-])N)C#N

Isomeric SMILES

C1COCC[NH2+]1.C1=CC(=CN=C1)C2C(=C(NC(=C2C#N)[S-])N)C#N

InChI

InChI=1S/C12H9N5S.C4H9NO/c13-4-8-10(7-2-1-3-16-6-7)9(5-14)12(18)17-11(8)15;1-3-6-4-2-5-1/h1-3,6,10,17-18H,15H2;5H,1-4H2