Chem
J-GLOBAL ID：200907016848249681   Nikkaji number：J904.924J

CVT-313

2,2′-[[6-[(4-メトキシベンジル)アミノ]-9-イソプロピル-9H-プリン-2-イル]イミノ]ビスエタノール
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： C20H28N6O3
Molecular formula furigana： C20-H28-N6-O3
Molecular weight： 400.483
InChI： InChI=1S/C20H28N6O3/c1-14(2)26-13-22-17-18(21-12-15-4-6-16(29-3)7-5-15)23-20(24-19(17)26)25(8-10-27)9-11-28/h4-7,13-14,27-28H,8-12H2,1-3H3,(H,21,23,24)
InChI key： NQVIIUBWMBHLOZ-UHFFFAOYSA-N
SMILES： COc1ccc(CNc2nc(nc3n(cnc23)C(C)C)N(CCO)CCO)cc1
Systematic name  (3)：
  • 2,2′-[[6-[(4-メトキシベンジル)アミノ]-9-イソプロピル-9H-プリン-2-イル]イミノ]ビスエタノール
  • 2-[(2-ヒドロキシエチル)(6-{[(4-メトキシフェニル)メチル]アミノ}-9-(プロパン-2-イル)-9H-プリン-2-イル)アミノ]エタン-1-オール
  • 2-[(2-hydroxyethyl)(6-{[(4-methoxyphenyl)methyl]amino}-9-(propan-2-yl)-9H-purin-2-yl)amino]ethan-1-ol
Other name (2)：
  • CVT-313
  • 2,2′-[[6-[(4-Methoxybenzyl)amino]-9-isopropyl-9H-purin-2-yl]imino]bisethanol
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