Chem
J-GLOBAL ID:200907049779414522   Nikkaji number:J1.429.183K

1,1′-(2,2′-Bipyridine-5,5′-diylbismethylene)bis[4-aminopyrimidine-2(1H)-one]

1,1′-(2,2′-ビピリジン-5,5′-ジイルビスメチレン)ビス[4-アミノピリミジン-2(1H)-オン]
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: C20H18N8O2
Molecular formula furigana: C20-H18-N8-O2
Molecular weight: 402.418
InChI: InChI=1S/C20H18N8O2/c21-17-5-7-27(19(29)25-17)11-13-1-3-15(23-9-13)16-4-2-14(10-24-16)12-28-8-6-18(22)26-20(28)30/h1-10H,11-12H2,(H2,21,25,29)(H2,22,26,30)
InChI key: PKTLUIGZJSAFSI-UHFFFAOYSA-N
SMILES: Nc1ccn(Cc2ccc(nc2)c2ccc(Cn3ccc(N)nc3=O)cn2)c(=O)n1
Systematic name  (3):
  • 1,1′-(2,2′-ビピリジン-5,5′-ジイルビスメチレン)ビス[4-アミノピリミジン-2(1H)-オン]
  • 4-アミノ-1-({5'-[(4-アミノ-2-オキソ-1,2-ジヒドロピリミジン-1-イル)メチル]-[2,2'-ビピリジン]-5-イル}メチル)-1,2-ジヒドロピリミジン-2-オン
  • 4-amino-1-({5'-[(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)methyl]-[2,2'-bipyridin]-5-yl}methyl)-1,2-dihydropyrimidin-2-one
Other name (1):
  • 1,1′-(2,2′-Bipyridine-5,5′-diylbismethylene)bis[4-aminopyrimidine-2(1H)-one]
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