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Substance Name: Thiazolium, 4,5-dihydro-2-(4-methoxyphenyl)-3-methyl-, iodide
RN: 96160-03-1
InChIKey: MIFGFVAFHWQLLM-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H14-N-O-S.I

Molecular Weight

  • 335.2036
 
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Names and Synonyms

Synonym

  • 4,5-Dihydro-2-(4-methoxyphenyl)-3-methylthiazolium iodide

Systematic Name

  • Thiazolium, 4,5-dihydro-2-(4-methoxyphenyl)-3-methyl-, iodide

Registry Numbers

CAS Registry Number

  • 96160-03-1

System Generated Number

  • 0096160031

Molecular Formulas

Molecular Formula

  • C11-H14-N-O-S.I

Molecular Formula Fragments

  • C11-H14-N-O-S
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C11H14NOS.HI/c1-12-7-8-14-11(12)9-3-5-10(13-2)6-4-9;/h3-6H,7-8H2,1-2H3;1H/q+1;/p-1

InChIKey

MIFGFVAFHWQLLM-UHFFFAOYSA-M

Smiles

S1C(=[N+](CC1)C)c1ccc(cc1)OC.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 175mg/kg (175mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 20, Pg. 16, 1985.