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Substance Name: 4-Isoquinolinecarbonitrile, 5,6,7,8-tetrahydro-3-amino-
RN: 53661-19-1
InChIKey: KBLVALNQDHHHHA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H11-N3

Molecular Weight

  • 173.218
 
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Names and Synonyms

Synonyms

  • 5,6,7,8-Tetrahydro-3-amino-4-isoquinolinecarbonitrile
  • 5-22-13-00661 (Beilstein Handbook Reference)
  • BRN 0394980

Systematic Name

  • 4-Isoquinolinecarbonitrile, 5,6,7,8-tetrahydro-3-amino-

Registry Numbers

CAS Registry Number

  • 53661-19-1

System Generated Number

  • 0053661191

Structure Descriptors

InChI

1S/C10H11N3/c11-5-9-8-4-2-1-3-7(8)6-13-10(9)12/h6H,1-4H2,(H2,12,13)

InChIKey

KBLVALNQDHHHHA-UHFFFAOYSA-N

Smiles

c1(c(ncc2c1CCCC2)N)C#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 500mg/kg (500mg/kg)   Pharmaceutical Chemistry Journal Vol. 24, Pg. 346, 1990.