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Substance Name: 1H-Pyrrole-2-carbothioamide, 1-propyl-
RN: 101001-65-4
InChIKey: VMKNKFIFJNMOEY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H12-N2-S

Molecular Weight

  • 168.2628
 
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Names and Synonyms

Synonyms

  • 1-n-Propylpyrrole-2-carbothioamide
  • 1-Propyl-1H-pyrrole-2-carbothioamide

Systematic Name

  • 1H-Pyrrole-2-carbothioamide, 1-propyl-

Registry Numbers

CAS Registry Number

  • 101001-65-4

System Generated Number

  • 0101001654

Structure Descriptors

InChI

1S/C8H12N2S/c1-2-5-10-6-3-4-7(10)8(9)11/h3-4,6H,2,5H2,1H3,(H2,9,11)

InChIKey

VMKNKFIFJNMOEY-UHFFFAOYSA-N

Smiles

CCCn1cccc1C(=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,