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Substance Name: Guanidine, 1-tert-butyl-3-(4-chloro-1,3-dimethyl-4-pyrazolyl)-2-cyano-
RN: 67026-69-1
InChIKey: DMSRVZDMPMDUBI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H17-Cl-N6

Molecular Weight

  • 268.7503
 
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Names and Synonyms

Synonyms

  • 1-tert-Butyl-3-(4-chloro-1,3-dimethyl-4-pyrazolyl)-2-cyanoguanidine
  • 5-25-09-00484 (Beilstein Handbook Reference)
  • BRN 0814712
  • Guanidine, N-(4-chloro-1,3-dimethyl-1H-pyrazol-5-yl)-N'-cyano-N''-(1,1-dimethylethyl)-

Systematic Name

  • Guanidine, 1-tert-butyl-3-(4-chloro-1,3-dimethyl-4-pyrazolyl)-2-cyano-

Registry Numbers

CAS Registry Number

  • 67026-69-1

System Generated Number

  • 0067026691

Structure Descriptors

InChI

1S/C11H17ClN6/c1-7-8(12)9(18(5)17-7)15-10(14-6-13)16-11(2,3)4/h1-5H3,(H2,14,15,16)

InChIKey

DMSRVZDMPMDUBI-UHFFFAOYSA-N

Smiles

Cc1c(c(n(n1)C)N/C(=N/C(C)(C)C)/NC#N)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 773, 1978.