Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ethanethiol, 2-(3-(5-bromo-2-pyridyloxy)propyl)amino-, hydrogen sulfate (ester)
RN: 41286-94-6
InChIKey: GDNKUULIIOQEJQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H15-Br-N2-O4-S2

Molecular Weight

  • 371.2745
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • BRN 1486383
  • Ethanethiosulfuric acid, 2-(3-(5-bromo-2-pyridyloxy)propyl)amino-
  • S-2-((3-(5-Bromo-2-pyridyloxy)propyl)amino)ethyl hydrogen thiosulfate
  • Thiosulfuric acid, S-(2-((3-(5-bromo-2-pyridyloxy)propyl)amino)ethyl) ester

Systematic Name

  • Ethanethiol, 2-(3-(5-bromo-2-pyridyloxy)propyl)amino-, hydrogen sulfate (ester)

Registry Numbers

CAS Registry Number

  • 41286-94-6

System Generated Number

  • 0041286946

Structure Descriptors

InChI

1S/C10H15BrN2O4S2/c11-9-2-3-10(13-8-9)17-6-1-4-12-5-7-18-19(14,15)16/h2-3,8,12H,1,4-7H2,(H,14,15,16)

InChIKey

GDNKUULIIOQEJQ-UHFFFAOYSA-N

Smiles

c1cc(ncc1Br)OCCCNCCSS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 125mg/kg (125mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 319, 1973.
mouse LD50 oral > 900mg/kg (900mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 319, 1973.