sodium 8-azanyl-3-methyl-6-sulfanylidene-3,4-dihydropyrimido[1,6-b][1,2,4]triazin-2-olate

Systemtic Name: sodium 8-azanyl-3-methyl-6-sulfanylidene-3,4-dihydropyrimido[1,6-b][1,2,4]triazin-2-olate Openeye Name: sodium 8-amino-3-methyl-6-thioxo-3,4-dihydropyrimido[1,6-b][1,2,4]triazin-2-olate CAS Name: sodium 8-amino-3-methyl-6-sulfanylidene-3,4-dihydropyrimido[1,6-b][1,2,4]triazin-2-olate IUPAC Name: sodium 8-amino-3-methyl-6-sulfanylidene-3,4-dihydropyrimido[1,6-b][1,2,4]triazin-2-olate Traditional Name: sodium 8-amino-3-methyl-6-thioxo-3,4-dihydropyrimido[1,6-b][1,2,4]triazin-2-olate Formula: C7H8N5NaOS MolecularWeight: 233.22609

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=NC2=CC(=NC(=S)N2N1)N)[O-].[Na+]

Isomeric SMILES

CC1C(=NC2=CC(=NC(=S)N2N1)N)[O-].[Na+]

InChI

InChI=1S/C7H9N5OS.Na/c1-3-6(13)10-5-2-4(8)9-7(14)12(5)11-3;/h2-3,11H,1H3,(H,10,13)(H2,8,9,14);/q;+1/p-1