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Substance Name: 9H-Purin-6-amine, 2-chloro-N-(3-(methylsulfonyl)phenyl)-9-(phenylmethyl)-
RN: 125802-65-5
InChIKey: HOIHHHULXKLFIW-UHFFFAOYSA-N

Molecular Formula

  • C19-H16-Cl-N5-O2-S

Molecular Weight

  • 413.8874
 
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Names and Synonyms

  • 9H-Purin-6-amine, 2-chloro-N-(3-(methylsulfonyl)phenyl)-9-(phenylmethyl)-

Registry Numbers

CAS Registry Number

  • 125802-65-5

System Generated Number

  • 0125802655

Structure Descriptors

InChI

1S/C19H16ClN5O2S/c1-28(26,27)15-9-5-8-14(10-15)22-17-16-18(24-19(20)23-17)25(12-21-16)11-13-6-3-2-4-7-13/h2-10,12H,11H2,1H3,(H,22,23,24)

InChIKey

HOIHHHULXKLFIW-UHFFFAOYSA-N

Smiles

CS(=O)(=O)c1cccc(Nc2nc(Cl)nc3c2ncn3Cc4ccccc4)c1