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Substance Name: Ethanethiol, 2-(5-(3,5-dichloro-2-pyridyloxy)pentyl)amino-, hydrochloride
RN: 41287-51-8
InChIKey: SXPONSAEIRBHLH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H18-Cl2-N2-O-S.Cl-H

Molecular Weight

  • 345.7201
 
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Names and Synonyms

Synonyms

  • 2-((5-(3,5-Dichloro-2-pyridyloxy)pentyl)amino)ethanethiol hydrochloride
  • Pyridine, 3,5-dichloro-2-(5-(2-mercaptoethyl)amino)pentyloxy-, hydrochloride

Systematic Name

  • Ethanethiol, 2-(5-(3,5-dichloro-2-pyridyloxy)pentyl)amino-, hydrochloride

Registry Numbers

CAS Registry Number

  • 41287-51-8

System Generated Number

  • 0041287518

Molecular Formulas

Molecular Formula

  • C12-H18-Cl2-N2-O-S.Cl-H

Molecular Formula Fragments

  • C12-H18-Cl2-N2-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H18Cl2N2OS.ClH/c13-10-8-11(14)12(16-9-10)17-6-3-1-2-4-15-5-7-18;/h8-9,15,18H,1-7H2;1H

InChIKey

SXPONSAEIRBHLH-UHFFFAOYSA-N

Smiles

c1c(cnc(c1Cl)OCCCCCNCCS)Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 130mg/kg (130mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 319, 1973.
mouse LD50 oral 510mg/kg (510mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 319, 1973.