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Substance Name: Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride
RN: 117125-53-8
InChIKey: PSAWGQATHZKSPQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H19-N-O2-S.Cl-H

Molecular Weight

  • 349.88
 
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Names and Synonyms

Synonyms

  • Ethyl 2-(6,11-dihydrodibenzo(b,e)thiepin-11-ylamino)acetate hydrochloride
  • N-(6,11-Dihydrodibenzo(b,e)thiepin-11-yl)glycine ethyl ester hydrochloride

Systematic Name

  • Glycine, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-, ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 117125-53-8

System Generated Number

  • 0117125538

Molecular Formulas

Molecular Formula

  • C18-H19-N-O2-S.Cl-H

Molecular Formula Fragments

  • C18-H19-N-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H19NO2S.ClH/c1-2-21-17(20)11-19-18-14-8-4-3-7-13(14)12-22-16-10-6-5-9-15(16)18;/h3-10,18-19H,2,11-12H2,1H3;1H

InChIKey

PSAWGQATHZKSPQ-UHFFFAOYSA-N

Smiles

CCOC(=O)CNC1c2ccccc2CSc3c1cccc3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 53, Pg. 860, 1988.