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Substance Name: Ethanethiol, 2-(5-(4-methyl-2-quinolyloxy)pentyl)amino-, hydrogen sulfate (ester)
RN: 41287-37-0
InChIKey: HBWWYZMOHJIFTI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H24-N2-O4-S2

Molecular Weight

  • 384.5186
 
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Names and Synonyms

Synonyms

  • BRN 1661536
  • Ethanethiosulfuric acid, 2-(5-(4-methyl-2-quinolyloxy)pentyl)amino-
  • S-2-(5-(4-Methyl-2-quinolyloxy)pentyl)aminoethyl hydrogen thiosulfate
  • Thiosulfuric acid, S-(2-((5-(4-methyl-2-quinolyloxy)pentyl)amino)ethyl) ester

Systematic Name

  • Ethanethiol, 2-(5-(4-methyl-2-quinolyloxy)pentyl)amino-, hydrogen sulfate (ester)

Registry Numbers

CAS Registry Number

  • 41287-37-0

System Generated Number

  • 0041287370

Structure Descriptors

InChI

1S/C17H24N2O4S2/c1-14-13-17(19-16-8-4-3-7-15(14)16)23-11-6-2-5-9-18-10-12-24-25(20,21)22/h3-4,7-8,13,18H,2,5-6,9-12H2,1H3,(H,20,21,22)

InChIKey

HBWWYZMOHJIFTI-UHFFFAOYSA-N

Smiles

Cc1cc(nc2c1cccc2)OCCCCCNCCSS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 740mg/kg (740mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 319, 1973.