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Substance Name: 1,3,5-Triazine-2,4-diamine, 1,6-dihydro-6,6-dimethyl-1-(4-((4-nitrophenyl)thio)phenyl)-, monohydrochloride
RN: 13413-53-1
InChIKey: UVCDEDVFYJTYHM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H18-N6-O2-S.Cl-H

Molecular Weight

  • 406.896
 
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Names and Synonyms

Synonyms

  • 1,6-Dihydro-6,6-dimethyl-1-(4-((4-nitrophenyl)thio)phenyl)-1,3,5-triazine-2,4-diamine HCl
  • 4-Nitro-4'-(2,4-diamino-6,6-dimethyl-1,6-dihydro-1,3,5-triazine)diphenyl sulfide HCl

Systematic Name

  • 1,3,5-Triazine-2,4-diamine, 1,6-dihydro-6,6-dimethyl-1-(4-((4-nitrophenyl)thio)phenyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 13413-53-1

System Generated Number

  • 0013413531

Molecular Formulas

Molecular Formula

  • C17-H18-N6-O2-S.Cl-H

Molecular Formula Fragments

  • C17-H18-N6-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H18N6O2S.ClH/c1-17(2)21-15(18)20-16(19)22(17)11-3-7-13(8-4-11)26-14-9-5-12(6-10-14)23(24)25;/h3-10H,1-2H3,(H4,18,19,20,21);1H

InChIKey

UVCDEDVFYJTYHM-UHFFFAOYSA-N

Smiles

N1(C(=NC(=NC1(C)C)N)N)c1ccc(cc1)Sc1ccc(cc1)[N+](=O)[O-].Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 240mg/kg (240mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 38, Pg. 425, 1986.