[1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(6H)-one, 7-(methylthio)-3-nitro-, sodium salt, hydrate (1:1:2)

CAS Registry Number®

928659-17-0
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CAS Name

[1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(6H)-one, 7-(methylthio)-3-nitro-, sodium salt, hydrate (1:1:2)

Molecular Formula

C5H4N6O3S.2H2O.Na

Cite this Page

[1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(6H)-one, 7-(methylthio)-3-nitro-, sodium salt, hydrate (1:1:2).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=928659-17-0 (retrieved 2021-09-18) (CAS RN: 928659-17-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C5H4N6O3S.Na.2H2O/c1-15-5-6-4-8-7-2(11(13)14)3(12)10(4)9-5;;;/h1H3,(H,6,8,9);;2*1H2

InChIKey

InChIKey=PNOMHWQEVJAFBG-UHFFFAOYSA-N

SMILES

O=C1N2C(NC(SC)=N2)=NN=C1N(=O)=O.[Na].O

Canonical SMILES

[Na].O=C1C(=NN=C2NC(=NN12)SC)N(=O)=O.O

Other Names for this Substance

  • [1,2,4]Triazolo[5,1-c][1,2,4]triazin-4(6H)-one, 7-(methylthio)-3-nitro-, sodium salt, hydrate (1:1:2)
  • Triazavirin

Deleted or Replaced CAS Registry Numbers

1159421-02-9