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Substance Name: Benzoic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride
RN: 108488-43-3
InChIKey: WJSMFPBTGWLQSR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H19-N-O-S.Cl-H

Molecular Weight

  • 273.826
 
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Names and Synonyms

Synonym

  • Thiobenzoic acid O-2-(diethylamino)ethyl ester hydrochloride

Systematic Name

  • Benzoic acid, thio-, O-2-(diethylamino)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 108488-43-3

System Generated Number

  • 0108488433

Molecular Formulas

Molecular Formula

  • C13-H19-N-O-S.Cl-H

Molecular Formula Fragments

  • C13-H19-N-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H19NOS.ClH/c1-3-14(4-2)10-11-15-13(16)12-8-6-5-7-9-12;/h5-9H,3-4,10-11H2,1-2H3;1H

InChIKey

WJSMFPBTGWLQSR-UHFFFAOYSA-N

Smiles

c1(C(OCCN(CC)CC)=S)ccccc1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 290mg/kg (290mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Therapie. Vol. 11, Pg. 117, 1956.