Chem
J-GLOBAL ID：200907052732057722   Nikkaji number：J2.121.745J

NPI-2358

NPI-2358
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： C19H20N4O2
Molecular formula furigana： C19-H20-N4-O2
Molecular weight： 336.395
InChI： InChI=1S/C19H20N4O2/c1-19(2,3)16-13(20-11-21-16)10-15-18(25)22-14(17(24)23-15)9-12-7-5-4-6-8-12/h4-11H,1-3H3,(H,20,21)(H,22,25)(H,23,24)/b14-9-,15-10-
InChI key： UNRCMCRRFYFGFX-TYPNBTCFSA-N
SMILES： CC(C)(C)c1[nH]cnc1/C=c/1\[nH]c(=O)/c(=C/c2ccccc2)/[nH]c1=O
Systematic name  (3)：
  • 2-[(Z)-ベンジリデン]-5-[(Z)-(5-tert-ブチル-1H-イミダゾール)-4-イルメチレン]ピペラジン-3,6-ジオン
  • (3Z,6Z)-3-[(5-tert-ブチル-1H-イミダゾール-4-イル)メチリデン]-6-(フェニルメチリデン)ピペラジン-2,5-ジオン
  • (3Z,6Z)-3-[(5-tert-butyl-1H-imidazol-4-yl)methylidene]-6-(phenylmethylidene)piperazine-2,5-dione
Other name (4)：
  • 2-[(Z)-Benzylidene]-5-[(Z)-(5-tert-butyl-1H-imidazole)-4-ylmethylene]piperazine-3,6-dione
  • NPI-2358
  • プリナブリン
  • Plinabulin
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