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Substance Name: Ethanethiol, 2-((5-(o-tolyloxy)pentyl)amino)-, hydrochloride
RN: 38920-67-1
InChIKey: HDEDKRHBZZCKTC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H23-N-O-S.Cl-H

Molecular Weight

  • 289.8686
 
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Names and Synonyms

Synonym

  • 2-((5-(o-Tolyloxy)pentyl)amino)ethanethiol hydrochloride

Systematic Name

  • Ethanethiol, 2-((5-(o-tolyloxy)pentyl)amino)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 38920-67-1

System Generated Number

  • 0038920671

Molecular Formulas

Molecular Formula

  • C14-H23-N-O-S.Cl-H

Molecular Formula Fragments

  • C14-H23-N-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H23NOS.ClH/c1-13-7-3-4-8-14(13)16-11-6-2-5-9-15-10-12-17;/h3-4,7-8,15,17H,2,5-6,9-12H2,1H3;1H

InChIKey

HDEDKRHBZZCKTC-UHFFFAOYSA-N

Smiles

Cc1ccccc1OCCCCCNCCS.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 968, 1972.