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Substance Name: Acetic acid, (phenylthio)-, 2-(dimethylamino)-1-methylethyl ester
RN: 35859-03-1
InChIKey: KBMNZFKXMZBZQO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H19-N-O2-S

Molecular Weight

  • 253.364
 
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Names and Synonyms

Synonyms

  • (Phenylthio)acetic acid 2-(dimethylamino)-1-methylethyl ester
  • BRN 2276037

Systematic Name

  • Acetic acid, (phenylthio)-, 2-(dimethylamino)-1-methylethyl ester

Registry Numbers

CAS Registry Number

  • 35859-03-1

System Generated Number

  • 0035859031

Structure Descriptors

InChI

1S/C13H19NO2S/c1-11(9-14(2)3)16-13(15)10-17-12-7-5-4-6-8-12/h4-8,11H,9-10H2,1-3H3

InChIKey

KBMNZFKXMZBZQO-UHFFFAOYSA-N

Smiles

c1(SCC(O[C@@H](CN(C)C)C)=O)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 79400ug/kg (79.4mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: ATAXIA

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Journal of Medicinal Chemistry. Vol. 14, Pg. 1004, 1971.