Chem
J-GLOBAL ID：200907046430528165   Nikkaji number：J1.796.536K

2-(4-Methylphenyl)-6-(benzylthio)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine

6-(ベンジルスルファニル)-2-(4-メチルフェニル)-9-(オキサン-2-イル)-9H-プリン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C24H24N4OS
Molecular formula furigana： C24-H24-N4-O-S
Molecular weight： 416.540
InChI： InChI=1S/C24H24N4OS/c1-17-10-12-19(13-11-17)22-26-23-21(25-16-28(23)20-9-5-6-14-29-20)24(27-22)30-15-18-7-3-2-4-8-18/h2-4,7-8,10-13,16,20H,5-6,9,14-15H2,1H3
InChI key： XBIZPJFMTZFMHY-UHFFFAOYSA-N
SMILES： Cc1ccc(cc1)c1nc(SCc2ccccc2)c2ncn(C3CCCCO3)c2n1
Systematic name  (3)：
  • 2-(4-メチルフェニル)-6-(ベンジルチオ)-9-(テトラヒドロ-2H-ピラン-2-イル)-9H-プリン
  • 6-(ベンジルスルファニル)-2-(4-メチルフェニル)-9-(オキサン-2-イル)-9H-プリン
  • 6-(benzylsulfanyl)-2-(4-methylphenyl)-9-(oxan-2-yl)-9H-purine
Other name (1)：
  • 2-(4-Methylphenyl)-6-(benzylthio)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine
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