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Substance Name: Thiazolium, 2-(p-(dimethylamino)phenyl)-3,5-dimethyl-4-phenyl-, iodide
RN: 21176-85-2
InChIKey: UIERLFLDNGIVQS-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H21-N2-S.I

Molecular Weight

  • 436.355
 
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Names and Synonyms

Synonym

  • 2-(p-(Dimethylamino)phenyl)-3,5-dimethyl-4-phenyl-thiazolium iodide

Systematic Name

  • Thiazolium, 2-(p-(dimethylamino)phenyl)-3,5-dimethyl-4-phenyl-, iodide

Registry Numbers

CAS Registry Number

  • 21176-85-2

System Generated Number

  • 0021176852

Molecular Formulas

Molecular Formula

  • C19-H21-N2-S.I

Molecular Formula Fragments

  • C19-H21-N2-S
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C19H21N2S.HI/c1-14-18(15-8-6-5-7-9-15)21(4)19(22-14)16-10-12-17(13-11-16)20(2)3;/h5-13H,1-4H3;1H/q+1;/p-1

InChIKey

UIERLFLDNGIVQS-UHFFFAOYSA-M

Smiles

s1c([n+](c(c1C)c1ccccc1)C)c1ccc(cc1)N(C)C.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 75mg/kg (75mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 1205, 1968.
mouse LD50 oral 750mg/kg (750mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 1205, 1968.