Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ethanethiol, 2-((4-cycloheptyloxy)butylamino)-, hydrogen sulfate (ester)
RN: 21209-27-8
InChIKey: UWIQSQLLKQZXMJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H27-N-O4-S2

Molecular Weight

  • 325.491
 
* 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

  • 2-((4-Cycloheptyloxy)butylamino)ethanethiol hydrogen sulfate (ester)
  • BRN 1988190
  • S-2-(((4-Cycloheptyloxy)butyl)amino)ethyl thiosulfate

Systematic Name

  • Ethanethiol, 2-((4-cycloheptyloxy)butylamino)-, hydrogen sulfate (ester)

Registry Numbers

CAS Registry Number

  • 21209-27-8

System Generated Number

  • 0021209278

Structure Descriptors

InChI

1S/C13H27NO4S2/c15-20(16,17)19-12-10-14-9-5-6-11-18-13-7-3-1-2-4-8-13/h13-14H,1-12H2,(H,15,16,17)

InChIKey

UWIQSQLLKQZXMJ-UHFFFAOYSA-N

Smiles

S(=O)(=O)(O)SCCNCCCCOC1CCCCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 1190, 1968.