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Substance Name: Ethanethiol, 2-(3-(6-chloro-4-methyl-2-quinolyloxy)propyl)amino-, hydrogen sulfate (ester)
RN: 41287-24-5
InChIKey: UIYBGSIWFJRRAZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H19-Cl-N2-O4-S2

Molecular Weight

  • 390.9101
 
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Names and Synonyms

Synonyms

  • BRN 1690530
  • Ethanethiosulfuric acid, 2-(3-(6-chloro-4-methyl-2-quinolyloxy)propyl)amino-
  • S-2-((3-(6-Chloro-4-methyl-2-quinolyloxy)propyl)amino)ethyl hydrogen thiosulfate
  • Thiosulfuric acid, S-(2-((3-(6-chloro-4-methyl-2-quinolyloxy)propyl)amino)ethyl) ester

Systematic Name

  • Ethanethiol, 2-(3-(6-chloro-4-methyl-2-quinolyloxy)propyl)amino-, hydrogen sulfate (ester)

Registry Numbers

CAS Registry Number

  • 41287-24-5

System Generated Number

  • 0041287245

Structure Descriptors

InChI

1S/C15H19ClN2O4S2/c1-11-9-15(18-14-4-3-12(16)10-13(11)14)22-7-2-5-17-6-8-23-24(19,20)21/h3-4,9-10,17H,2,5-8H2,1H3,(H,19,20,21)

InChIKey

UIYBGSIWFJRRAZ-UHFFFAOYSA-N

Smiles

Cc1cc(nc2c1cc(cc2)Cl)OCCCNCCSS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 75mg/kg (75mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 319, 1973.
mouse LD50 oral > 600mg/kg (600mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 319, 1973.