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Substance Name: 1H-Pyrrole-1-ethanethiol, 2-butyl-5-methyl-
RN: 153687-01-5
InChIKey: HYPJBJPQHQDPPM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H19-N-S

Molecular Weight

  • 197.3441
 
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Names and Synonyms

Synonym

  • 2-Butyl-5-methyl N-ethanethiol pyrrole

Systematic Name

  • 1H-Pyrrole-1-ethanethiol, 2-butyl-5-methyl-

Registry Numbers

CAS Registry Number

  • 153687-01-5

System Generated Number

  • 0153687015

Structure Descriptors

InChI

1S/C11H19NS/c1-3-4-5-11-7-6-10(2)12(11)8-9-13/h6-7,13H,3-5,8-9H2,1-2H3

InChIKey

HYPJBJPQHQDPPM-UHFFFAOYSA-N

Smiles

CCCCc1ccc(n1CCS)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1600mg/kg (1600mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 28, Pg. 703, 1993.