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Substance Name: 1,3,5-Triazaspiro(5.5)undeca-2,4-diene, 2,4-diamino-1-(2,6-dimethylphenyl)-9-methyl-, hydrochloride
RN: 73941-01-2
InChIKey: CYIMZEJFKXSADU-UHFFFAOYSA-N

Molecular Formula

  • C17-H25-N5.Cl-H

Molecular Weight

  • 335.8804
 
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Names and Synonyms

Synonym

  • 2,4-Diamino-1-(2,6-dimethylphenyl)-9-methyl-1,3,5-triazspiro(5.5)undeca-2,4-diene HCl

Systematic Name

  • 1,3,5-Triazaspiro(5.5)undeca-2,4-diene, 2,4-diamino-1-(2,6-dimethylphenyl)-9-methyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 73941-01-2

System Generated Number

  • 0073941012

Molecular Formulas

Molecular Formula

  • C17-H25-N5.Cl-H

Molecular Formula Fragments

  • C17-H25-N5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H25N5.ClH/c1-11-7-9-17(10-8-11)21-15(18)20-16(19)22(17)14-12(2)5-4-6-13(14)3;/h4-6,11H,7-10H2,1-3H3,(H4,18,19,20,21);1H

InChIKey

CYIMZEJFKXSADU-UHFFFAOYSA-N

Smiles

Cc1cccc(c1N2C(=NC(=NC23CCC(CC3)C)N)N)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 56mg/kg (56mg/kg)   Journal of Medicinal Chemistry. Vol. 6, Pg. 370, 1963.
mouse LD50 oral 1180mg/kg (1180mg/kg)   Journal of Medicinal Chemistry. Vol. 6, Pg. 370, 1963.