Chem
J-GLOBAL ID：200907002460369935   Nikkaji number：J816.134H

(S)-2-[[6-(4-Aminobenzylamino)-9-[2-(3-thienyl)ethyl]-9H-purin-2-yl]amino]-3-phenyl-1-propanol

(S)-2-[[6-(4-アミノベンジルアミノ)-9-[2-(3-チエニル)エチル]-9H-プリン-2-イル]アミノ]-3-フェニル-1-プロパノール
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： C27H29N7OS
Molecular formula furigana： C27-H29-N7-O-S
Molecular weight： 499.640
InChI： InChI=1S/C27H29N7OS/c28-22-8-6-20(7-9-22)15-29-25-24-26(34(18-30-24)12-10-21-11-13-36-17-21)33-27(32-25)31-23(16-35)14-19-4-2-1-3-5-19/h1-9,11,13,17-18,23,35H,10,12,14-16,28H2,(H2,29,31,32,33)/t23-/m0/s1
InChI key： PRIGZZKKJDSWJI-QHCPKHFHSA-N
SMILES： Nc1ccc(CNc2nc(N[C@H](CO)Cc3ccccc3)nc3n(CCc4ccsc4)cnc23)cc1
Systematic name  (3)：
  • (S)-2-[[6-(4-アミノベンジルアミノ)-9-[2-(3-チエニル)エチル]-9H-プリン-2-イル]アミノ]-3-フェニル-1-プロパノール
  • (2S)-2-[(6-{[(4-アミノフェニル)メチル]アミノ}-9-[2-(チオフェン-3-イル)エチル]-9H-プリン-2-イル)アミノ]-3-フェニルプロパン-1-オール
  • (2S)-2-[(6-{[(4-aminophenyl)methyl]amino}-9-[2-(thiophen-3-yl)ethyl]-9H-purin-2-yl)amino]-3-phenylpropan-1-ol
Other name (1)：
  • (S)-2-[[6-(4-Aminobenzylamino)-9-[2-(3-thienyl)ethyl]-9H-purin-2-yl]amino]-3-phenyl-1-propanol
Thsaurus map：
Thesaurus Map

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