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Substance Name: Guanidine, 2-cyano-1-tert-pentyl-3-(3-pyridyl)-, 1'-oxide
RN: 67026-63-5
InChIKey: YXOREYACUQMEEO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H17-N5-O

Molecular Weight

  • 247.3003
 
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Names and Synonyms

Synonyms

  • 2-Cyano-1-tert-pentyl-3-(3-pyridyl)guanidine 1'-oxide
  • BRN 0410760
  • Guanidine, N-cyano-N'-(1,1-dimethylpropyl)-N''-3-pyridinyl-, N-oxide
  • N''-Cyano-N-1-oxido-3-pyridyl-N'-tert-pentylguanidine

Systematic Name

  • Guanidine, 2-cyano-1-tert-pentyl-3-(3-pyridyl)-, 1'-oxide

Registry Numbers

CAS Registry Number

  • 67026-63-5

System Generated Number

  • 0067026635

Structure Descriptors

InChI

1S/C12H17N5O/c1-4-12(2,3)16-11(14-9-13)15-10-6-5-7-17(18)8-10/h5-8H,4H2,1-3H3,(H2,14,15,16)

InChIKey

YXOREYACUQMEEO-UHFFFAOYSA-N

Smiles

CCC(C)(C)N/C(=N\c1cccn(=O)c1)/NC#N

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.