Chem
J-GLOBAL ID：200907063720332738   Nikkaji number：J1.499.257J

N-[(1R)-1-(Hydroxymethyl)propyl]-N′-(3,4-dichlorobenzyl)-9-methyl-9H-purine-2,6-diamine

N-[(1R)-1-(ヒドロキシメチル)プロピル]-N′-(3,4-ジクロロベンジル)-9-メチル-9H-プリン-2,6-ジアミン
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： C17H20Cl2N6O
Molecular formula furigana： C17-H20-CL2-N6-O
Molecular weight： 395.290
InChI： InChI=1S/C17H20Cl2N6O/c1-3-11(8-26)22-17-23-15(14-16(24-17)25(2)9-21-14)20-7-10-4-5-12(18)13(19)6-10/h4-6,9,11,26H,3,7-8H2,1-2H3,(H2,20,22,23,24)/t11-/m1/s1
InChI key： HIDOOWINYZYMRD-LLVKDONJSA-N
SMILES： CC[C@H](CO)Nc1nc(NCc2ccc(Cl)c(Cl)c2)c2ncn(C)c2n1
Systematic name  (3)：
  • N-[(1R)-1-(ヒドロキシメチル)プロピル]-N′-(3,4-ジクロロベンジル)-9-メチル-9H-プリン-2,6-ジアミン
  • (2R)-2-[(6-{[(3,4-ジクロロフェニル)メチル]アミノ}-9-メチル-9H-プリン-2-イル)アミノ]ブタン-1-オール
  • (2R)-2-[(6-{[(3,4-dichlorophenyl)methyl]amino}-9-methyl-9H-purin-2-yl)amino]butan-1-ol
Other name (1)：
  • N-[(1R)-1-(Hydroxymethyl)propyl]-N′-(3,4-dichlorobenzyl)-9-methyl-9H-purine-2,6-diamine
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