Chem
J-GLOBAL ID：200907028269780667   Nikkaji number：J1.558.160C

2-[4-(Sodiosulfooxy)benzyl]-6-[4-(sodiosulfooxy)phenyl]-8-benzylimidazo[1,2-a]pyrazine-3(7H)-one

2-[4-(ソジオスルホオキシ)ベンジル]-6-[4-(ソジオスルホオキシ)フェニル]-8-ベンジルイミダゾ[1,2-a]ピラジン-3(7H)-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： C26H19N3Na2O9S2
Molecular formula furigana： C26-H19-N3-NA2-O9-S2
Molecular weight： 627.550
InChI： InChI=1S/C26H21N3O9S2.2Na/c30-26-23(15-18-6-10-20(11-7-18)37-39(31,32)33)28-25-22(14-17-4-2-1-3-5-17)27-24(16-29(25)26)19-8-12-21(13-9-19)38-40(34,35)36;;/h1-13,16,27H,14-15H2,(H,31,32,33)(H,34,35,36);;/q;2*+1/p-2
InChI key： LTFJNKFKSVSVBK-UHFFFAOYSA-L
SMILES： [Na]OS(=O)(=O)Oc1ccc(Cc2nc3c(Cc4ccccc4)[nH]c(cn3c2=O)c2ccc(OS(=O)(=O)O[Na])cc2)cc1
Systematic name  (3)：
  • 2-[4-(ソジオスルホオキシ)ベンジル]-6-[4-(ソジオスルホオキシ)フェニル]-8-ベンジルイミダゾ[1,2-a]ピラジン-3(7H)-オン
  • 4-{[8-ベンジル-3-オキソ-6-(4-{[(ソジオオキシ)スルホニル]オキシ}フェニル)-3H,7H-イミダゾ[1,2-a]ピラジン-2-イル]メチル}フェニル ナトリウム スルファート
  • 4-{[8-benzyl-3-oxo-6-(4-{[(sodiooxy)sulfonyl]oxy}phenyl)-3H,7H-imidazo[1,2-a]pyrazin-2-yl]methyl}phenyl sodium sulfate
Other name (1)：
  • 2-[4-(Sodiosulfooxy)benzyl]-6-[4-(sodiosulfooxy)phenyl]-8-benzylimidazo[1,2-a]pyrazine-3(7H)-one
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