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Substance Name: Ammonium, (5-((4,6-dimethyl-2-pyrimidinyl)thio)pentyl)triethyl-, bromide
RN: 90094-33-0
InChIKey: VMEBDOSROCWIBH-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H32-N3-S.Br

Molecular Weight

  • 390.431
 
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Names and Synonyms

Synonyms

  • (5-((4,6-Dimethyl-2-pyrimidinyl)thio)pentyl)triethylammonium bromide
  • 1-Pentanaminium, 5-((4,6-dimethyl-2-pyrimidinyl)thio)-N,N,N-triethyl-, bromide

Systematic Name

  • Ammonium, (5-((4,6-dimethyl-2-pyrimidinyl)thio)pentyl)triethyl-, bromide

Registry Numbers

CAS Registry Number

  • 90094-33-0

System Generated Number

  • 0090094330

Molecular Formulas

Molecular Formula

  • C17-H32-N3-S.Br

Molecular Formula Fragments

  • Br
  • C17-H32-N3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C17H32N3S.BrH/c1-6-20(7-2,8-3)12-10-9-11-13-21-17-18-15(4)14-16(5)19-17;/h14H,6-13H2,1-5H3;1H/q+1;/p-1

InChIKey

VMEBDOSROCWIBH-UHFFFAOYSA-M

Smiles

[N+](CCCCCSc1nc(cc(n1)C)C)(CC)(CC)CC.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 60mg/kg (60mg/kg)   Russian Pharmacology and Toxicology Vol. 47, Pg. 67, 1984.