(1-ethyl-4-methyl-2-oxidanyl-6-oxidanylidene-pyridin-3-yl)methanesulfonic acid; 2,4,6-tris(azanyl)pyridine-3-carbonitrile

Systemtic Name: (1-ethyl-4-methyl-2-oxidanyl-6-oxidanylidene-pyridin-3-yl)methanesulfonic acid; 2,4,6-tris(azanyl)pyridine-3-carbonitrile Openeye Name: (1-ethyl-2-hydroxy-4-methyl-6-oxo-3-pyridyl)methanesulfonic acid; 2,4,6-triaminopyridine-3-carbonitrile CAS Name: (1-ethyl-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)methanesulfonic acid; 2,4,6-triamino-3-pyridinecarbonitrile IUPAC Name: (1-ethyl-2-hydroxy-4-methyl-6-oxopyridin-3-yl)methanesulfonic acid; 2,4,6-triaminopyridine-3-carbonitrile Traditional Name: (1-ethyl-2-hydroxy-6-keto-4-methyl-3-pyridyl)methanesulfonic acid; 2,4,6-triaminonicotinonitrile Formula: C15H20N6O5S MolecularWeight: 396.4215

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C=C(C(=C1O)CS(=O)(=O)O)C.C1=C(C(=C(N=C1N)N)C#N)N

Isomeric SMILES

CCN1C(=O)C=C(C(=C1O)CS(=O)(=O)O)C.C1=C(C(=C(N=C1N)N)C#N)N

InChI

InChI=1S/C9H13NO5S.C6H7N5/c1-3-10-8(11)4-6(2)7(9(10)12)5-16(13,14)15;7-2-3-4(8)1-5(9)11-6(3)10/h4,12H,3,5H2,1-2H3,(H,13,14,15);1H,(H6,8,9,10,11)