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Substance Name: 5H-Pyrrolo(1,2-a)imidazolium, 6,7-dihydro-1-methyl-2-(methylthio)-, iodide
RN: 128366-12-1
InChIKey: TVSOECVKLFFFDP-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H13-N2-S.I

Molecular Weight

  • 296.1707
 
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Names and Synonyms

Synonym

  • 6,7-Dihydro-1-methyl-2-(methylthio)-5H-pyrrolo(1,2-a)imidazolium iodide

Systematic Name

  • 5H-Pyrrolo(1,2-a)imidazolium, 6,7-dihydro-1-methyl-2-(methylthio)-, iodide

Registry Numbers

CAS Registry Number

  • 128366-12-1

System Generated Number

  • 0128366121

Molecular Formulas

Molecular Formula

  • C8-H13-N2-S.I

Molecular Formula Fragments

  • C8-H13-N2-S
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C8H13N2S.HI/c1-9-7-4-3-5-10(7)6-8(9)11-2;/h6H,3-5H2,1-2H3;1H/q+1;/p-1

InChIKey

TVSOECVKLFFFDP-UHFFFAOYSA-M

Smiles

C[n+]1c(cn2c1CCC2)SC.[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 500mg/kg (500mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 24(4), Pg. 7, 1990.