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Substance Name: Benzonitrile, 4-((2-chloro-9-(phenylmethyl)-9H-purin-6-yl)amino)-
RN: 125802-53-1
InChIKey: NVQXKMMKLNDXDK-UHFFFAOYSA-N

Molecular Formula

  • C19-H13-Cl-N6

Molecular Weight

  • 360.8067
 
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Names and Synonyms

  • Benzonitrile, 4-((2-chloro-9-(phenylmethyl)-9H-purin-6-yl)amino)-

Registry Numbers

CAS Registry Number

  • 125802-53-1

System Generated Number

  • 0125802531

Structure Descriptors

InChI

1S/C19H13ClN6/c20-19-24-17(23-15-8-6-13(10-21)7-9-15)16-18(25-19)26(12-22-16)11-14-4-2-1-3-5-14/h1-9,12H,11H2,(H,23,24,25)

InChIKey

NVQXKMMKLNDXDK-UHFFFAOYSA-N

Smiles

Clc1nc(Nc2ccc(cc2)C#N)c3ncn(Cc4ccccc4)c3n1