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Substance Name: Ethanethiol, 2-(5-(cyclohexylmethoxy)pentyl)amino-, hydrogen sulfate (ester)
RN: 21224-41-9
InChIKey: UYMVJGHGINEMTJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H29-N-O4-S2

Molecular Weight

  • 339.518
 
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Names and Synonyms

Synonyms

  • 2-(((5-Cyclohexylmethoxy)pentyl)amino)ethanethiol hydrogen sulfate (ester)
  • BRN 1993656
  • S-2-(((5-Cyclohexylmethoxy)pentyl)amino)ethyl thiosulfate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 21224-41-9

System Generated Number

  • 0021224419

Structure Descriptors

InChI

1S/C14H29NO4S2/c16-21(17,18)20-12-10-15-9-5-2-6-11-19-13-14-7-3-1-4-8-14/h14-15H,1-13H2,(H,16,17,18)

InChIKey

UYMVJGHGINEMTJ-UHFFFAOYSA-N

Smiles

S(=O)(=O)(O)SCCNCCCCCOCC1CCCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 18mg/kg (18mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 1190, 1968.