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Substance Name: Benzoic acid, m-(methylthio)-, 2-(diethylamino)ethyl ester
RN: 67031-95-2
InChIKey: ASNIXICSPYDHKP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C114-H21-N-O2-S

Molecular Weight

  • 267.3909
 
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Names and Synonyms

Synonyms

  • beta-Diethylaminoethyl m-methylthiobenzoate
  • m-(Methylthio)benzoic acid 2-(diethylamino)ethyl ester

Systematic Name

  • Benzoic acid, m-(methylthio)-, 2-(diethylamino)ethyl ester

Registry Numbers

CAS Registry Number

  • 67031-95-2

System Generated Number

  • 0067031952

Structure Descriptors

InChI

1S/C14H21NO2S/c1-4-15(5-2)9-10-17-14(16)12-7-6-8-13(11-12)18-3/h6-8,11H,4-5,9-10H2,1-3H3

InChIKey

ASNIXICSPYDHKP-UHFFFAOYSA-N

Smiles

CCN(CC)CCOC(=O)c1cccc(c1)SC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 510mg/kg (510mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 68, Pg. 395, 1940.