Chem
J-GLOBAL ID：200907066750017224   Nikkaji number：J999.861F

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

5,5′-[(3,3′-ジメチル-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： C24H20N6O6
Molecular formula furigana： C24-H20-N6-O6
Molecular weight： 488.460
InChI： InChI=1S/C24H20N6O6/c1-11-7-13(3-5-17(11)25-9-15-19(31)27-23(35)28-20(15)32)14-4-6-18(12(2)8-14)26-10-16-21(33)29-24(36)30-22(16)34/h3-10,15-16H,1-2H3,(H2,27,28,31,32,35)(H2,29,30,33,34,36)
InChI key： UJAYSYZTHZEGJK-UHFFFAOYSA-N
SMILES： Cc1cc(ccc1N=CC1C(=O)NC(=O)NC1=O)c1ccc(N=CC2C(=O)NC(=O)NC2=O)c(C)c1
Systematic name  (4)：
  • 5,5′-[(3,3′-ジメチル-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′-ジメチル-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'-ジメチル-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'-dimethyl-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′-Dimethyl-1,1′-biphenyl-4,4′-diyl)bis(nitrilomethylidyne)]bis[pyrimidine-2,4,6(1H,3H,5H)-trione]
  • 5,5′-[(3,3′-Dimethyl-1,1′-biphenyl-4,4′-diyl)bis(nitrilomethylidyne)]bis(hexahydropyrimidine-2,4,6-trione)
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