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Substance Name: Cyclopropanecarbothioic acid, 1-phenyl-, S-(2-(diethylamino)ethyl) ester, hydrochloride
RN: 67239-15-0
InChIKey: OFGJGABBWLFNFM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H23-N-O-S.Cl-H

Molecular Weight

  • 313.891
 
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Names and Synonyms

Synonym

  • 1-Phenylcyclopropanecarbothioic acid S-(2-(diethylamino)ethyl) ester hydrochloride

Systematic Name

  • Cyclopropanecarbothioic acid, 1-phenyl-, S-(2-(diethylamino)ethyl) ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 67239-15-0

System Generated Number

  • 0067239150

Molecular Formulas

Molecular Formula

  • C16-H23-N-O-S.Cl-H

Molecular Formula Fragments

  • C16-H23-N-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H23NOS.ClH/c1-3-17(4-2)12-13-19-15(18)16(10-11-16)14-8-6-5-7-9-14;/h5-9H,3-4,10-13H2,1-2H3;1H

InChIKey

OFGJGABBWLFNFM-UHFFFAOYSA-N

Smiles

C1(c2ccccc2)(CC1)C(SCC[NH+](CC)CC)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 220mg/kg (220mg/kg)   Journal of the American Chemical Society. Vol. 68, Pg. 2345, 1946.