Chem
J-GLOBAL ID：200907008706946390   Nikkaji number：J999.865I

5,5′-[[3,3′-Bis(2-methoxyethoxy)-1,1′-biphenyl-4,4′-diyl]bis(nitrilomethylidyne)]bis(hexahydropyrimidine-2,4,6-trione)

5,5′-[[3,3′-ビス(2-メトキシエトキシ)-1,1′-ビフェニル-4,4′-ジイル]ビス(ニトリロメチリジン)]ビス(ヘキサヒドロピリミジン-2,4,6-トリオン)
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： C28H28N6O10
Molecular formula furigana： C28-H28-N6-O10
Molecular weight： 608.564
InChI： InChI=1S/C28H28N6O10/c1-41-7-9-43-21-11-15(3-5-19(21)29-13-17-23(35)31-27(39)32-24(17)36)16-4-6-20(22(12-16)44-10-8-42-2)30-14-18-25(37)33-28(40)34-26(18)38/h3-6,11-14,17-18H,7-10H2,1-2H3,(H2,31,32,35,36,39)(H2,33,34,37,38,40)
InChI key： PQHOCEORFIGAHB-UHFFFAOYSA-N
SMILES： COCCOc1cc(ccc1N=CC1C(=O)NC(=O)NC1=O)c1ccc(N=CC2C(=O)NC(=O)NC2=O)c(OCCOC)c1
Systematic name  (4)：
  • 5,5′-[[3,3′-ビス(2-メトキシエトキシ)-1,1′-ビフェニル-4,4′-ジイル]ビス(ニトリロメチリジン)]ビス[ピリミジン-2,4,6(1H,3H,5H)-トリオン]
  • 5,5′-[[3,3′-ビス(2-メトキシエトキシ)-1,1′-ビフェニル-4,4′-ジイル]ビス(ニトリロメチリジン)]ビス(ヘキサヒドロピリミジン-2,4,6-トリオン)
  • 5-({[3,3'-ビス(2-メトキシエトキシ)-4'-{[(2,4,6-トリオキソ-1,3-ジアジナン-5-イル)メチリデン]アミノ}-[1,1'-ビフェニル]-4-イル]イミノ}メチル)-1,3-ジアジナン-2,4,6-トリオン
  • 5-({[3,3'-bis(2-methoxyethoxy)-4'-{[(2,4,6-trioxo-1,3-diazinan-5-yl)methylidene]amino}-[1,1'-biphenyl]-4-yl]imino}methyl)-1,3-diazinane-2,4,6-trione
Other name (2)：
  • 5,5′-[[3,3′-Bis(2-methoxyethoxy)-1,1′-biphenyl-4,4′-diyl]bis(nitrilomethylidyne)]bis[pyrimidine-2,4,6(1H,3H,5H)-trione]
  • 5,5′-[[3,3′-Bis(2-methoxyethoxy)-1,1′-biphenyl-4,4′-diyl]bis(nitrilomethylidyne)]bis(hexahydropyrimidine-2,4,6-trione)
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