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Substance Name: Oxythiamine chloride hydrochloride
RN: 614-05-1
UNII: HM0RL1Q94J
InChIKey: HGYQKVVWNZFPJS-UHFFFAOYSA-N

Molecular Formula

  • C12-H16-N3-O2-S.Cl.Cl-H

Molecular Weight

  • 338.257
 
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Names and Synonyms

Results Name

  • Oxythiamine chloride hydrochloride

Name of Substance

  • Oxythiamine chloride hydrochloride

Synonyms

  • Hydroxythiamine chloride hydrochloride
  • Oxythiamine chloride HCl
  • Oxythiamine chloride hydrochloride
  • UNII-HM0RL1Q94J

Systematic Name

  • Thiazolium, 3-((1,4-dihydro-2-methyl-4-oxo-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-methyl-, chloride, monohydrochloride

Registry Numbers

CAS Registry Number

  • 614-05-1

FDA UNII

  • HM0RL1Q94J

System Generated Number

  • 0000614051

Molecular Formulas

Molecular Formula

  • C12-H16-N3-O2-S.Cl.Cl-H

Molecular Formula Fragments

  • C12-H16-N3-O2-S
  • Cl
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H15N3O2S.2ClH/c1-8-11(3-4-16)18-7-15(8)6-10-5-13-9(2)14-12(10)17;;/h5,7,16H,3-4,6H2,1-2H3;2*1H

InChIKey

HGYQKVVWNZFPJS-UHFFFAOYSA-N

Smiles

[n+]1(c(c(CCO)sc1)C)Cc1c(nc(C)[nH]c1)=O.[ClH-].Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 1835mg/kg (1835mg/kg)   Voprosy Meditsinskoi Khimii. Problems of Medical Chemistry. Vol. 33, Pg. 70, 1987.