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Substance Name: 4H-4,7-Ethanothieno(2,3-b)pyridine-3-carboxylic acid, 5,6-dihydro-2-((3,4,5-trimethoxybenzoyl)amino)-, ethyl ester
RN: 112290-20-7
InChIKey: DKARQXMCTKDTCD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H26-N2-O6-S

Molecular Weight

  • 446.5214
 
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Names and Synonyms

Synonyms

  • 2-(3,4,5-Trimethoxybenzoylamino)-3-ethoxycarbonylthieno(2,3-b)quinuclidine
  • BRN 5780658

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 112290-20-7

System Generated Number

  • 0112290207

Structure Descriptors

InChI

1S/C22H26N2O6S/c1-5-30-22(26)17-16-12-6-8-24(9-7-12)21(16)31-20(17)23-19(25)13-10-14(27-2)18(29-4)15(11-13)28-3/h10-12H,5-9H2,1-4H3,(H,23,25)

InChIKey

DKARQXMCTKDTCD-UHFFFAOYSA-N

Smiles

CCOC(=O)c1c2c(sc1NC(=O)c3cc(c(c(c3)OC)OC)OC)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.