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Substance Name: Carbamic acid, benzyldithio-, 4-chloro-2-nitrobenzyl ester
RN: 19457-07-9
InChIKey: WFFYCHMRRWUMBQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H13-Cl-N2-O2-S2

Molecular Weight

  • 352.865
 
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Names and Synonyms

Synonym

  • Benzyldithiocarbamic acid 4-chloro-2-nitrobenzyl ester

Systematic Name

  • Carbamic acid, benzyldithio-, 4-chloro-2-nitrobenzyl ester

Registry Numbers

CAS Registry Number

  • 19457-07-9

System Generated Number

  • 0019457079

Structure Descriptors

InChI

1S/C15H13ClN2O2S2/c16-13-7-6-12(14(8-13)18(19)20)10-22-15(21)17-9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,17,21)

InChIKey

WFFYCHMRRWUMBQ-UHFFFAOYSA-N

Smiles

c1(c(cc(Cl)cc1)[N+](=O)[O-])CSC(NCc1ccccc1)=S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 300mg/kg (300mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 121, 1971.