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Substance Name: 1,3-Propanediamine, N,N-diethyl-N'-(2-nitrobenzo(b)thien-3-yl)-
RN: 128554-84-7
InChIKey: XCDVAIVFCBYSGG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H21-N3-O2-S

Molecular Weight

  • 307.4159
 
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Names and Synonyms

Synonyms

  • BRN 3559189
  • N,N-Diethyl-N'-(2-nitrobenzo(b)thien-3-yl)-1,3-propanediamine

Systematic Name

  • 1,3-Propanediamine, N,N-diethyl-N'-(2-nitrobenzo(b)thien-3-yl)-

Registry Numbers

CAS Registry Number

  • 128554-84-7

System Generated Number

  • 0128554847

Structure Descriptors

InChI

1S/C15H21N3O2S/c1-3-17(4-2)11-7-10-16-14-12-8-5-6-9-13(12)21-15(14)18(19)20/h5-6,8-9,16H,3-4,7,10-11H2,1-2H3

InChIKey

XCDVAIVFCBYSGG-UHFFFAOYSA-N

Smiles

CCN(CC)CCCNc1c2ccccc2sc1[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Farmaco. Vol. 45, Pg. 29, 1990.
mouse LD50 oral 800mg/kg (800mg/kg)   Farmaco. Vol. 45, Pg. 29, 1990.