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Substance Name: Ethanol, 2-((7-methyl-2-(methylthio)-7H-purin-6-yl)amino)-
RN: 104802-80-4
InChIKey: NJBHDAQJSMGJKA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H13-N5-O-S

Molecular Weight

  • 239.3017
 
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Names and Synonyms

Synonyms

  • 2-((7-Methyl-2-(methylthio)-7H-purin-6-yl)amino)ethanol
  • 2-Methylthio-6-hydroxyethylamino-7-methylpurine
  • BRN 5558417

Systematic Name

  • Ethanol, 2-((7-methyl-2-(methylthio)-7H-purin-6-yl)amino)-

Registry Numbers

CAS Registry Number

  • 104802-80-4

System Generated Number

  • 0104802804

Structure Descriptors

InChI

1S/C9H13N5OS/c1-14-5-11-8-6(14)7(10-3-4-15)12-9(13-8)16-2/h5,15H,3-4H2,1-2H3,(H,10,12,13)

InChIKey

NJBHDAQJSMGJKA-UHFFFAOYSA-N

Smiles

Cn1cnc2c1c(nc(n2)SC)NCCO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1630mg/kg (1630mg/kg)   Pharmaceutical Chemistry Journal Vol. 20, Pg. 493, 1986.