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Substance Name: Ethanethiol, 2-(5-(2-quinolyloxy)pentyl)amino-, hydrogen sulfate (ester)
RN: 41287-30-3
InChIKey: YAMYUNXLJMWLTK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H22-N2-O4-S2

Molecular Weight

  • 370.4918
 
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Names and Synonyms

Synonyms

  • BRN 1658206
  • Ethanethiosulfuric acid, 2-(5-(2-quinolyloxy)pentyl)amino-
  • S-2-((5-(2-Quinolyloxy)pentyl)amino)ethyl hydrogen thiosulfate
  • Thiosulfuric acid, S-(2-((5-(2-quinolyloxy)pentyl)amino)ethyl) ester

Systematic Name

  • Ethanethiol, 2-(5-(2-quinolyloxy)pentyl)amino-, hydrogen sulfate (ester)

Registry Numbers

CAS Registry Number

  • 41287-30-3

System Generated Number

  • 0041287303

Structure Descriptors

InChI

1S/C16H22N2O4S2/c19-24(20,21)23-13-11-17-10-4-1-5-12-22-16-9-8-14-6-2-3-7-15(14)18-16/h2-3,6-9,17H,1,4-5,10-13H2,(H,19,20,21)

InChIKey

YAMYUNXLJMWLTK-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)ccc(n2)OCCCCCNCCSS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 25mg/kg (25mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 319, 1973.