Chem
J-GLOBAL ID:200907061865032322   Nikkaji number:J1.614.353G

(2R)-1-[6-(Benzylthio)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine-2-yl]pyrrolidine-2-methanol

[(2R)-1-[6-(ベンジルスルファニル)-9-(オキサン-2-イル)-9H-プリン-2-イル]ピロリジン-2-イル]メタノール
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: C22H27N5O2S
Molecular formula furigana: C22-H27-N5-O2-S
Molecular weight: 425.550
InChI: InChI=1S/C22H27N5O2S/c28-13-17-9-6-11-26(17)22-24-20-19(23-15-27(20)18-10-4-5-12-29-18)21(25-22)30-14-16-7-2-1-3-8-16/h1-3,7-8,15,17-18,28H,4-6,9-14H2/t17-,18?/m1/s1
InChI key: XWQYTZHFQXEXKK-QNSVNVJESA-N
SMILES: OC[C@H]1CCCN1c1nc(SCc2ccccc2)c2ncn(C3CCCCO3)c2n1
Systematic name  (4):
  • 2-[(2R)-2-(ヒドロキシメチル)ピロリジノ]-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
  • (2R)-1-[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-2-イル]ピロリジン-2-メタノール
  • [(2R)-1-[6-(ベンジルスルファニル)-9-(オキサン-2-イル)-9H-プリン-2-イル]ピロリジン-2-イル]メタノール
  • [(2R)-1-[6-(benzylsulfanyl)-9-(oxan-2-yl)-9H-purin-2-yl]pyrrolidin-2-yl]methanol
Other name (2):
  • 2-[(2R)-2-(Hydroxymethyl)pyrrolizino]-6-(benzylthio)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine
  • (2R)-1-[6-(Benzylthio)-9-(tetrahydro-2H-pyran-2-yl)-9H-purine-2-yl]pyrrolidine-2-methanol
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