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Substance Name: 1,4-Benzenediamine, N-(5-chloro-2-nitrobenzo(b)thien-3-yl)-N',N'-dimethyl-
RN: 149338-23-8
InChIKey: QSAQQWYPLXFCLG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H14-Cl-N3-O2-S

Molecular Weight

  • 347.8246
 
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Names and Synonyms

Synonyms

  • BRN 5828137
  • N-(5-Chloro-2-nitrobenzo(b)thien-3-yl)-N',N'-dimethyl-1,4-benzenediamine

Systematic Name

  • 1,4-Benzenediamine, N-(5-chloro-2-nitrobenzo(b)thien-3-yl)-N',N'-dimethyl-

Registry Numbers

CAS Registry Number

  • 149338-23-8

System Generated Number

  • 0149338238

Structure Descriptors

InChI

1S/C16H14ClN3O2S/c1-19(2)12-6-4-11(5-7-12)18-15-13-9-10(17)3-8-14(13)23-16(15)20(21)22/h3-9,18H,1-2H3

InChIKey

QSAQQWYPLXFCLG-UHFFFAOYSA-N

Smiles

CN(C)c1ccc(cc1)Nc2c3cc(ccc3sc2[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.