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Substance Name: 1H-Pyrrole-2-carbothioamide, 1-(2-propenyl)-
RN: 101001-70-1
InChIKey: PGIUFQXXLLAUIR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H10-N2-S

Molecular Weight

  • 166.247
 
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Names and Synonyms

Synonyms

  • 1-(2-Propenyl)-1H-pyrrole-2-carbothioamide
  • 1-Allylpyrrole-2-carbothioamide

Systematic Name

  • 1H-Pyrrole-2-carbothioamide, 1-(2-propenyl)-

Registry Numbers

CAS Registry Number

  • 101001-70-1

System Generated Number

  • 0101001701

Structure Descriptors

InChI

1S/C8H10N2S/c1-2-5-10-6-3-4-7(10)8(9)11/h2-4,6H,1,5H2,(H2,9,11)

InChIKey

PGIUFQXXLLAUIR-UHFFFAOYSA-N

Smiles

C=CCn1cccc1C(=S)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 3gm/kg (3000mg/kg)   United States Patent Document. Vol. #4659726,