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Substance Name: 1,2-Ethanediamine, N-(5-chloro-2-nitrobenzo(b)thien-3-yl)-N',N'-diethyl-
RN: 149338-17-0
InChIKey: WPWKBILUBOXSNL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H18-Cl-N3-O2-S

Molecular Weight

  • 327.8342
 
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Names and Synonyms

Synonyms

  • BRN 5825009
  • N-(5-Chloro-2-nitrobenzo(b)thien-3-yl)-N',N'-diethyl-1,2-ethanediamine

Systematic Name

  • 1,2-Ethanediamine, N-(5-chloro-2-nitrobenzo(b)thien-3-yl)-N',N'-diethyl-

Registry Numbers

CAS Registry Number

  • 149338-17-0

System Generated Number

  • 0149338170

Structure Descriptors

InChI

1S/C14H18ClN3O2S/c1-3-17(4-2)8-7-16-13-11-9-10(15)5-6-12(11)21-14(13)18(19)20/h5-6,9,16H,3-4,7-8H2,1-2H3

InChIKey

WPWKBILUBOXSNL-UHFFFAOYSA-N

Smiles

CCN(CC)CCNc1c2cc(ccc2sc1[N+](=O)[O-])Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 500mg/kg (500mg/kg)   Farmaco. Vol. 47, Pg. 1149, 1992.
mouse LD50 oral > 1gm/kg (1000mg/kg)   Farmaco. Vol. 47, Pg. 1149, 1992.