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Substance Name: Ethanethiol, 2-(6-(3,5-dibromo-2-pyridyloxy)hexyl)amino-, hydrogen sulfate (ester)
RN: 41287-09-6
InChIKey: MYAPKIZEEJRDPD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H20-Br2-N2-O4-S2

Molecular Weight

  • 492.251
 
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Names and Synonyms

Synonyms

  • BRN 1503123
  • Ethanethiosulfuric acid, 2-(6-(3,5-dibromo-2-pyridyloxy)hexyl)amino-
  • S-2-((6-(3,5-Dibromo-2-pyridyloxy)hexyl)amino)ethyl hydrogen thiosulfate

Systematic Name

  • Ethanethiol, 2-(6-(3,5-dibromo-2-pyridyloxy)hexyl)amino-, hydrogen sulfate (ester)

Registry Numbers

CAS Registry Number

  • 41287-09-6

System Generated Number

  • 0041287096

Structure Descriptors

InChI

1S/C13H20Br2N2O4S2/c14-11-9-12(15)13(17-10-11)21-7-4-2-1-3-5-16-6-8-22-23(18,19)20/h9-10,16H,1-8H2,(H,18,19,20)

InChIKey

MYAPKIZEEJRDPD-UHFFFAOYSA-N

Smiles

c1c(cnc(c1Br)OCCCCCCNCCSS(=O)(=O)O)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 250mg/kg (250mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 319, 1973.