6-azanyl-3,5-dicyano-4-phenyl-1,4-dihydropyridine-2-thiolate; 4-methylmorpholin-4-ium

Systemtic Name: 6-azanyl-3,5-dicyano-4-phenyl-1,4-dihydropyridine-2-thiolate; 4-methylmorpholin-4-ium Openeye Name: 6-amino-3,5-dicyano-4-phenyl-1,4-dihydropyridine-2-thiolate; 4-methylmorpholin-4-ium CAS Name: 6-amino-3,5-dicyano-4-phenyl-1,4-dihydropyridine-2-thiolate; 4-methylmorpholin-4-ium IUPAC Name: 6-amino-3,5-dicyano-4-phenyl-1,4-dihydropyridine-2-thiolate; 4-methylmorpholin-4-ium Traditional Name: 6-amino-3,5-dicyano-4-phenyl-1,4-dihydropyridine-2-thiolate; 4-methylmorpholin-4-ium Formula: C18H21N5OS MolecularWeight: 355.45724

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCOCC1.C1=CC=C(C=C1)C2C(=C(NC(=C2C#N)[S-])N)C#N

Isomeric SMILES

C[NH+]1CCOCC1.C1=CC=C(C=C1)C2C(=C(NC(=C2C#N)[S-])N)C#N

InChI

InChI=1S/C13H10N4S.C5H11NO/c14-6-9-11(8-4-2-1-3-5-8)10(7-15)13(18)17-12(9)16;1-6-2-4-7-5-3-6/h1-5,11,17-18H,16H2;2-5H2,1H3