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Substance Name: 2-Thiophenecarboxylic acid, alpha-(1-pyrrolidinylmethyl)benzyl ester
RN: 101584-77-4
InChIKey: ZWTDZPDPZQBRRV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H19-N-O2-S

Molecular Weight

  • 301.4081
 
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Names and Synonyms

Synonyms

  • 4-20-00-00144 (Beilstein Handbook Reference)
  • alpha-(1-Pyrrolidinylmethyl)benzyl 2-thiophenecarboxylate
  • BRN 0289078

Systematic Name

  • 2-Thiophenecarboxylic acid, alpha-(1-pyrrolidinylmethyl)benzyl ester

Registry Numbers

CAS Registry Number

  • 101584-77-4

System Generated Number

  • 0101584774

Structure Descriptors

InChI

1S/C17H19NO2S/c19-17(16-9-6-12-21-16)20-15(13-18-10-4-5-11-18)14-7-2-1-3-8-14/h1-3,6-9,12,15H,4-5,10-11,13H2

InChIKey

ZWTDZPDPZQBRRV-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C(CN2CCCC2)OC(=O)c3cccs3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 300mg/kg (300mg/kg)   Journal of the American Chemical Society. Vol. 81, Pg. 203, 1959.