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Substance Name: 2,6-Dithiopurine
RN: 5437-25-2
InChIKey: VQPMXSMUUILNFZ-UHFFFAOYSA-N

Note

  • Inhibits the binding of a benzo(a)pyrene diol epoxide to DNA in mouse epidermis.

Molecular Formula

  • C5-H4-N4-S2

Molecular Weight

  • 184.2466
 
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Names and Synonyms

Name of Substance

  • 2,6-Dithiopurine

Synonyms

  • 2,6-Dimercapto-7H-purine
  • 2,6-Dithiopurine
  • 2,6-Dithioxanthine
  • AI3-52072
  • Dithioxanthine
  • EINECS 226-608-8
  • NSC 15989
  • Purine-2,6-dithiol

Systematic Names

  • 1H-Purine-2,6-dithione, 3,7-dihydro- (9CI)
  • 3,7-Dihydro-1H-purine-2,6-dithione
  • Purine-2,6-dithiol
  • Xanthine, dithio- (7CI,8CI)

Registry Numbers

CAS Registry Number

  • 5437-25-2

System Generated Number

  • 0005437252

Structure Descriptors

InChI

1S/C5H4N4S2/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11)

InChIKey

VQPMXSMUUILNFZ-UHFFFAOYSA-N

Smiles

c1[nH]c2c(n1)[nH]c(=S)[nH]c2=S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#03045,