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Substance Name: Benzonitrile, 4-(6-(1-pyrrolidinyl)-1,2,4-triazolo(3,4-a)phthalazin-3-yl)-
RN: 87540-05-4
InChIKey: USXONRHOMIBRPS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H16-N6

Molecular Weight

  • 340.388
 
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Names and Synonyms

Synonyms

  • 4-(6-(1-Pyrrolidinyl)-1,2,4-triazolo(3,4-a)phthalazin-3-yl)benzonitrile
  • BRN 6439699

Systematic Name

  • Benzonitrile, 4-(6-(1-pyrrolidinyl)-1,2,4-triazolo(3,4-a)phthalazin-3-yl)-

Registry Numbers

CAS Registry Number

  • 87540-05-4

System Generated Number

  • 0087540054

Structure Descriptors

InChI

1S/C20H16N6/c21-12-14-6-8-15(9-7-14)19-23-24-20-16-4-3-5-18(25-10-1-2-11-25)17(16)13-22-26(19)20/h3-9,13H,1-2,10-11H2

InChIKey

USXONRHOMIBRPS-UHFFFAOYSA-N

Smiles

c12n(c(c3ccc(C#N)cc3)nn2)ncc2c1cccc2N1CCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 600mg/kg (600mg/kg)   Journal of Medicinal Chemistry. Vol. 31, Pg. 1115, 1988.