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Substance Name: Ammonium, trimethyl(4-(trimethylureido)-2-butynyl)-, iodide
RN: 3854-10-2
InChIKey: CHADWXJCXRXPCH-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H22-N3-O.I

Molecular Weight

  • 339.215
 
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Names and Synonyms

Synonym

  • Trimethyl(4-(N,N,N'-trimethylureido)but-2-ynyl)ammonium iodide

Systematic Names

  • 2-Butyn-1-aminium, 4-(((dimethylamino)carbonyl)methylamino)-N,N,N-trimethyl-, iodide (9CI)
  • Ammonium, trimethyl(4-(trimethylureido)-2-butynyl)-, iodide

Registry Numbers

CAS Registry Number

  • 3854-10-2

System Generated Number

  • 0003854102

Molecular Formulas

Molecular Formula

  • C11-H22-N3-O.I

Molecular Formula Fragments

  • C11-H22-N3-O
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C11H22N3O.HI/c1-12(2)11(15)13(3)9-7-8-10-14(4,5)6;/h9-10H2,1-6H3;1H/q+1;/p-1

InChIKey

CHADWXJCXRXPCH-UHFFFAOYSA-M

Smiles

C(N(CC#CC[N+](C)(C)C)C)(N(C)C)=O.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 14mg/kg (14mg/kg)   British Journal of Pharmacology and Chemotherapy. Vol. 26, Pg. 56, 1966.