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Substance Name: 2-Thiophenecarboxylic acid, 3-(2,5-dimethyl-1-pyrrolyl)propyl ester
RN: 92251-10-0
InChIKey: CCZCWAYEVADLRI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H17-N-O2-S

Molecular Weight

  • 263.3593
 
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Names and Synonyms

Synonyms

  • 2-Thenoate de gamma-(2,5-dimethyl-1-pyrryl)propyle
  • 2-Thenoate de gamma-(2,5-dimethyl-1-pyrryl)propyle [French]
  • 3-(2,5-Dimethyl-1-pyrrolyl)propyl ester of 2-thiophenecarboxylic acid
  • 4-20-00-02123 (Beilstein Handbook Reference)
  • BRN 0225389

Systematic Name

  • 2-Thiophenecarboxylic acid, 3-(2,5-dimethyl-1-pyrrolyl)propyl ester

Registry Numbers

CAS Registry Number

  • 92251-10-0

System Generated Number

  • 0092251100

Structure Descriptors

InChI

1S/C14H17NO2S/c1-11-6-7-12(2)15(11)8-4-9-17-14(16)13-5-3-10-18-13/h3,5-7,10H,4,8-9H2,1-2H3

InChIKey

CCZCWAYEVADLRI-UHFFFAOYSA-N

Smiles

Cc1ccc(C)n1CCCOC(=O)c2cccs2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1500mg/kg (1500mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 108, Pg. 180, 1956.