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Substance Name: Carbamodithioic acid, diethyl-, 2-((4-ethoxyphenyl)amino)-2-((4-ethoxyphenyl)imino)ethyl ester
RN: 105858-95-5
InChIKey: MYFYXBKMVQWMLB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H31-N3-O2-S2

Molecular Weight

  • 445.649
 
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Names and Synonyms

Synonyms

  • BRN 6007754
  • Diethylcarbamodithioic acid 2-((4-ethoxyphenyl)amino)-2-((4-ethoxyphenyl)imino)ethyl ester

Systematic Name

  • Carbamodithioic acid, diethyl-, 2-((4-ethoxyphenyl)amino)-2-((4-ethoxyphenyl)imino)ethyl ester

Registry Numbers

CAS Registry Number

  • 105858-95-5

System Generated Number

  • 0105858955

Structure Descriptors

InChI

1S/C23H31N3O2S2/c1-5-26(6-2)23(29)30-17-22(24-18-9-13-20(14-10-18)27-7-3)25-19-11-15-21(16-12-19)28-8-4/h9-16H,5-8,17H2,1-4H3,(H,24,25)

InChIKey

MYFYXBKMVQWMLB-UHFFFAOYSA-N

Smiles

C(\Nc1ccc(OCC)cc1)(=N\c1ccc(OCC)cc1)CSC(N(CC)CC)=S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1240mg/kg (1240mg/kg)   Journal of Medicinal Chemistry. Vol. 30, Pg. 720, 1987.