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Substance Name: Guanidine, 2-cyano-1-(alpha,alpha-dimethylbenzyl)-3-(4-pyridyl)-
RN: 67026-58-8
InChIKey: ZGSOPNJKMFFMHY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H17-N5

Molecular Weight

  • 279.3453
 
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Names and Synonyms

Synonyms

  • 2-Cyano-1-(alpha,alpha-dimethylbenzyl)-3-(4-pyridyl)guanidine
  • BRN 0424502
  • Guanidine, N-cyano-N'-(1-methyl-1-phenylethyl)-N''-4-pyridinyl-

Systematic Name

  • Guanidine, 2-cyano-1-(alpha,alpha-dimethylbenzyl)-3-(4-pyridyl)-

Registry Numbers

CAS Registry Number

  • 67026-58-8

System Generated Number

  • 0067026588

Structure Descriptors

InChI

1S/C16H17N5/c1-16(2,13-6-4-3-5-7-13)21-15(19-12-17)20-14-8-10-18-11-9-14/h3-11H,1-2H3,(H2,18,19,20,21)

InChIKey

ZGSOPNJKMFFMHY-UHFFFAOYSA-N

Smiles

CC(C)(c1ccccc1)N/C(=N\c2ccncc2)/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.