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Substance Name: 9H-Purin-6-amine, N-(4-butoxyphenyl)-2-chloro-9-(phenylmethyl)-
RN: 125827-87-4
InChIKey: FSCRDKFVTWQAHM-UHFFFAOYSA-N

Molecular Formula

  • C22-H22-Cl-N5-O

Molecular Weight

  • 407.9028
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 125827-87-4

System Generated Number

  • 0125827874

Structure Descriptors

InChI

1S/C22H22ClN5O/c1-2-3-13-29-18-11-9-17(10-12-18)25-20-19-21(27-22(23)26-20)28(15-24-19)14-16-7-5-4-6-8-16/h4-12,15H,2-3,13-14H2,1H3,(H,25,26,27)

InChIKey

FSCRDKFVTWQAHM-UHFFFAOYSA-N

Smiles

CCCCOc1ccc(Nc2nc(Cl)nc3c2ncn3Cc4ccccc4)cc1