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Substance Name: 1,3,5-Benzenetricarbonitrile, 4,6-bis(isopropylamino)-2-chloro-
RN: 67205-52-1
InChIKey: KAEVGVKBFDCYOV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H16-Cl-N5

Molecular Weight

  • 301.7794
 
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Names and Synonyms

Synonyms

  • 2-Chloro-4,6-di(isopropylamino)-1,3,5-benzenetricarbonitrile
  • 2-Chloro-4,6-di(isopropylamino)trimesonitrile
  • BRN 2895009

Systematic Name

  • 1,3,5-Benzenetricarbonitrile, 4,6-bis(isopropylamino)-2-chloro-

Registry Numbers

CAS Registry Number

  • 67205-52-1

System Generated Number

  • 0067205521

Structure Descriptors

InChI

1S/C15H16ClN5/c1-8(2)20-14-10(5-17)13(16)11(6-18)15(12(14)7-19)21-9(3)4/h8-9,20-21H,1-4H3

InChIKey

KAEVGVKBFDCYOV-UHFFFAOYSA-N

Smiles

CC(C)Nc1c(c(c(c(c1C#N)Cl)C#N)NC(C)C)C#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 300mg/kg (300mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 906, 1978.