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Substance Name: Ethanethiol, 2-hexadecylamino-, hydrogen sulfate (ester)
RN: 929-45-3
InChIKey: NDCVPWSONNZYKP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H39-N-O3-S2

Molecular Weight

  • 381.642
 
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Names and Synonyms

Synonyms

  • 2-Hexadecylaminoethanethiol hydrogen sulfate (ester)
  • BRN 2382158

Systematic Name

  • Ethanethiol, 2-hexadecylamino-, hydrogen sulfate (ester)

Registry Numbers

CAS Registry Number

  • 929-45-3

System Generated Number

  • 0000929453

Structure Descriptors

InChI

1S/C18H39NO3S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-17-18-23-24(20,21)22/h19H,2-18H2,1H3,(H,20,21,22)

InChIKey

NDCVPWSONNZYKP-UHFFFAOYSA-N

Smiles

S(=O)(=O)(SCCNCCCCCCCCCCCCCCCC)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 251, 1970.