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Substance Name: 4H-4,7-Ethanothieno(2,3-b)pyridine-3-carboxylic acid, 5,6-dihydro-2-(((4-chlorophenoxy)acetyl)amino)-, ethyl ester
RN: 112290-21-8
InChIKey: WQGKLJCFLHVUOA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-Cl-N2-O4-S

Molecular Weight

  • 420.9149
 
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Names and Synonyms

Synonyms

  • 2-(4-Chlorophenoxyacetylamino)-3-ethoxycarbonylthieno(2,3-b)quinuclidine
  • BRN 5777019

Systematic Name

  • 4H-4,7-Ethanothieno(2,3-b)pyridine-3-carboxylic acid, 5,6-dihydro-2-(((4-chlorophenoxy)acetyl)amino)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 112290-21-8

System Generated Number

  • 0112290218

Structure Descriptors

InChI

1S/C20H21ClN2O4S/c1-2-26-20(25)17-16-12-7-9-23(10-8-12)19(16)28-18(17)22-15(24)11-27-14-5-3-13(21)4-6-14/h3-6,12H,2,7-11H2,1H3,(H,22,24)

InChIKey

WQGKLJCFLHVUOA-UHFFFAOYSA-N

Smiles

CCOC(=O)c1c2c(sc1NC(=O)COc3ccc(cc3)Cl)N4CCC2CC4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2gm/kg (2000mg/kg)   Pharmaceutical Chemistry Journal Vol. 21, Pg. 568, 1987.