Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)thio)-1-(4-propoxyphenyl)-, monohydrochloride
RN: 130623-16-4
InChIKey: VUKCVARRWLFVBZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H18-N2-O2-S.Cl-H

Molecular Weight

  • 314.8351
 
* 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

  • 2-((4,5-Dihydro-1H-imidazol-2-yl)thio)-1-(4-propoxyphenyl)ethanone monohydrochloride
  • Acetophenone, 2-(2-imidazolin-2-ylthio)-4'-propoxy-, monohydrochloride

Systematic Name

  • Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)thio)-1-(4-propoxyphenyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 130623-16-4

System Generated Number

  • 0130623164

Molecular Formulas

Molecular Formula

  • C14-H18-N2-O2-S.Cl-H

Molecular Formula Fragments

  • C14-H18-N2-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H18N2O2S.ClH/c1-2-9-18-12-5-3-11(4-6-12)13(17)10-19-14-15-7-8-16-14;/h3-6H,2,7-10H2,1H3,(H,15,16);1H

InChIKey

VUKCVARRWLFVBZ-UHFFFAOYSA-N

Smiles

CCCOc1ccc(cc1)C(=O)CSC2=NCCN2.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 302mg/kg (302mg/kg)   Pharmaceutical Chemistry Journal Vol. 28, Pg. 455, 1994.