Sodium pyrithione

C5H4NNaOSCAS 3811-73-2149.14 g/mol

Open in Covalent MOL file
O−N+S−Na+
Thiol

Properties

Molecular formula
C5H4NNaOS
Molar mass
149.14 g/mol
Exact mass
148.9911 Da
logP
0.23Crippen estimate
Polar surface area
26.9 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
3811-73-2
SMILES
[O-][n+]1ccccc1[S-].[Na+]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

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Names and synonyms

27 names · show all
  • 2-Pyridinethiol, 1-oxide, sodium salt (1:1)
  • 2-Pyridinethiol, 1-oxide, sodium salt
  • Sodium, (2-pyridylthio)-, N-oxide
  • 2-Pyridinethiol, 1-oxide, sodium deriv.
  • Sodium 2-mercaptopyridine 1-oxide
  • Sodium 2-pyridinethiol 1-oxide
  • Sodium, (2-pyridinylthio)-, N-oxide
  • Sodium 2-pyridinethiol N-oxide
  • Thione (reagent)
  • 2-Mercaptopyridine N-oxide sodium salt
  • Sodium 2-pyridinethiolate 1-oxide
  • 2-Mercaptopyridine oxide sodium salt
  • 2-Pyridinethiol N-oxide sodium salt
  • 1-Oxo-2-pyridinethiol sodium salt
  • 2-Mercaptopyridine 1-oxide sodium salt
  • Sodium pyridine-2-thione-N-oxide
  • Sodium 2-mercaptopyridine N-oxide
  • Sodium pyridine-1-oxide-2-thiolate
  • 2-Pyridylthiol-N-oxide sodium salt
  • Topcide 280
  • San-aibac Sodium Omadine
  • Sodium 2-pyridinethiolate N-oxide
  • Tomicide S
  • Hokucide N 100
  • Sodium (2-pyridylthio-1-oxide)
  • Hokucide N38
  • Starcide SP 40

Work with Sodium pyrithione

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

2-Mercaptopyridine N-oxide1121-31-9Free acid

Similar compounds

2-Hydroxypyridine N-oxide13161-30-343 % similar 2-Chloropyridine N-oxide2402-95-143 % similar Dipyrithione3696-28-443 % similar 2-Methylpyridine 1-oxide931-19-143 % similar Chloride 2-chloropyridinium 1-oxide20295-64-139 % similar 2-Bromopyridine N-oxide hydrobromide206860-49-339 % similar 2-Bromopyridine N-oxide hydrochloride80866-91-739 % similar Quinoline 1-oxide1613-37-239 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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