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Substance Name: 9H-Purin-6-amine, N-(4-butylphenyl)-2-chloro-9-(phenylmethyl)-
RN: 125802-44-0
InChIKey: IBENBZXSOOWVKG-UHFFFAOYSA-N

Molecular Formula

  • C22-H22-Cl-N5

Molecular Weight

  • 391.9038
 
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Names and Synonyms

  • 9H-Purin-6-amine, N-(4-butylphenyl)-2-chloro-9-(phenylmethyl)-

Registry Numbers

CAS Registry Number

  • 125802-44-0

System Generated Number

  • 0125802440

Structure Descriptors

InChI

1S/C22H22ClN5/c1-2-3-7-16-10-12-18(13-11-16)25-20-19-21(27-22(23)26-20)28(15-24-19)14-17-8-5-4-6-9-17/h4-6,8-13,15H,2-3,7,14H2,1H3,(H,25,26,27)

InChIKey

IBENBZXSOOWVKG-UHFFFAOYSA-N

Smiles

CCCCc1ccc(Nc2nc(Cl)nc3c2ncn3Cc4ccccc4)cc1