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Substance Name: 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis-
RN: 123392-12-1
InChIKey: VKOJMFASCCFCKW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H14-N6-S2

Molecular Weight

  • 294.4056
 
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Names and Synonyms

Synonyms

  • 1,3-Bis(4-aminopyrimidinyl-2-thio)propane
  • 2,2'-(1,3-Propanediylbis(thio))bis(4-pyrimidinamine)

Systematic Name

  • 4-Pyrimidinamine, 2,2'-(1,3-propanediylbis(thio))bis-

Registry Numbers

CAS Registry Number

  • 123392-12-1

System Generated Number

  • 0123392121

Structure Descriptors

InChI

1S/C11H14N6S2/c12-8-2-4-14-10(16-8)18-6-1-7-19-11-15-5-3-9(13)17-11/h2-5H,1,6-7H2,(H2,12,14,16)(H2,13,15,17)

InChIKey

VKOJMFASCCFCKW-UHFFFAOYSA-N

Smiles

c1cnc(nc1N)SCCCSc2nccc(n2)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 3500mg/kg (3500mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 579, 1989.