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Substance Name: Purine, 6-(butylthio)-
RN: 5069-82-9
InChIKey: VSDRAVPZXXXJDG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H12-N4-S

Molecular Weight

  • 208.2878
 
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Names and Synonyms

Synonyms

  • 6-(Butylmercapto)purine
  • 6-(Butylthio)purine
  • 6-Butyl MP
  • 6-n-Butylmercaptopurine
  • AI3-50234
  • EINECS 225-774-9
  • NSC 17205
  • Purine, 6-(butylthio)-
  • SRI 712

Systematic Names

  • 1H-Purine, 6-(butylthio)- (9CI)
  • 6-(Butylthio)-1H-purine
  • Purine, 6-(butylthio)-

Registry Numbers

CAS Registry Number

  • 5069-82-9

System Generated Number

  • 0005069829

Structure Descriptors

InChI

1S/C9H12N4S/c1-2-3-4-14-9-7-8(11-5-10-7)12-6-13-9/h5-6H,2-4H2,1H3,(H,10,11,12,13)

InChIKey

VSDRAVPZXXXJDG-UHFFFAOYSA-N

Smiles

CCCCSc1c2c(nc[nH]2)ncn1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 parenteral 181mg/kg (181mg/kg)   Journal of Pharmaceutical Sciences. Vol. 71, Pg. 618, 1982.