(2R,3S,4S)-3-carbamothioyl-3,5-dicyano-2,4-dipyridin-3-yl-2,4-dihydro-1H-pyridine-6-thiolate; morpholin-4-ium

Systemtic Name: (2R,3S,4S)-3-carbamothioyl-3,5-dicyano-2,4-dipyridin-3-yl-2,4-dihydro-1H-pyridine-6-thiolate; morpholin-4-ium Openeye Name: (2R,3S,4S)-3-carbamothioyl-3,5-dicyano-2,4-bis(3-pyridyl)-2,4-dihydro-1H-pyridine-6-thiolate; morpholin-4-ium CAS Name: (2R,3S,4S)-3-carbamothioyl-3,5-dicyano-2,4-bis(3-pyridinyl)-2,4-dihydro-1H-pyridine-6-thiolate; morpholin-4-ium IUPAC Name: (2R,3S,4S)-3-carbamothioyl-3,5-dicyano-2,4-dipyridin-3-yl-2,4-dihydro-1H-pyridine-6-thiolate; morpholin-4-ium Traditional Name: (2R,3S,4S)-3,5-dicyano-2,4-bis(3-pyridyl)-3-thiocarbamoyl-2,4-dihydro-1H-pyridine-6-thiolate; morpholin-4-ium Formula: C22H23N7OS2 MolecularWeight: 465.59432

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH2+]1.C1=CC(=CN=C1)C2C(=C(NC(C2(C#N)C(=S)N)C3=CN=CC=C3)[S-])C#N

Isomeric SMILES

C1COCC[NH2+]1.C1=CC(=CN=C1)[C@H]2C(=C(N[C@@H]([C@@]2(C#N)C(=S)N)C3=CN=CC=C3)[S-])C#N

InChI

InChI=1S/C18H14N6S2.C4H9NO/c19-7-13-14(11-3-1-5-22-8-11)18(10-20,17(21)26)15(24-16(13)25)12-4-2-6-23-9-12;1-3-6-4-2-5-1/h1-6,8-9,14-15,24-25H,(H2,21,26);5H,1-4H2/t14-,15+,18-;/m0./s1