Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Picolinium, 4-isopropylthio-, iodide
RN: 101976-25-4
InChIKey: XWAFADWPSKNRMA-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H14-N-S.I

Molecular Weight

  • 295.1826
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 4-Isopropylthiopicolinium iodide
  • Pan-W-47
  • Pyridinium, 4-isopropylthio-1-methyl-, iodide

Systematic Name

  • Picolinium, 4-isopropylthio-, iodide

Registry Numbers

CAS Registry Number

  • 101976-25-4

System Generated Number

  • 0101976254

Molecular Formulas

Molecular Formula

  • C9-H14-N-S.I

Molecular Formula Fragments

  • C9-H14-N-S
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C9H14NS.HI/c1-8(2)11-9-4-6-10(3)7-5-9;/h4-8H,1-3H3;1H/q+1;/p-1

InChIKey

XWAFADWPSKNRMA-UHFFFAOYSA-M

Smiles

CC(C)Sc1cc[n+](cc1)C.[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 85mg/kg (85mg/kg)   Pharmazie. Vol. 33, Pg. 120, 1978.