Chem
J-GLOBAL ID：200907043129688409   Nikkaji number：J576.161A

SUN-8399

4-[4-[4-(2-ピリミジニル)-1-ピペラジニル]ブチル]-1,4-ベンゾオキサゼピン-3,5(2H,4H)-ジオン
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： C21H25N5O3
Molecular formula furigana： C21-H25-N5-O3
Molecular weight： 395.463
InChI： InChI=1S/C21H25N5O3/c27-19-16-29-18-7-2-1-6-17(18)20(28)26(19)11-4-3-10-24-12-14-25(15-13-24)21-22-8-5-9-23-21/h1-2,5-9H,3-4,10-16H2
InChI key： ITTHDTFPCPHJOU-UHFFFAOYSA-N
SMILES： O=C1COc2ccccc2C(=O)N1CCCCN1CCN(CC1)c1ncccn1
Systematic name  (3)：
  • 4-[4-[4-(2-ピリミジニル)-1-ピペラジニル]ブチル]-1,4-ベンゾオキサゼピン-3,5(2H,4H)-ジオン
  • 4-{4-[4-(ピリミジン-2-イル)ピペラジン-1-イル]ブチル}-2,3,4,5-テトラヒドロ-1,4-ベンゾオキサゼピン-3,5-ジオン
  • 4-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}-2,3,4,5-tetrahydro-1,4-benzoxazepine-3,5-dione
Other name (2)：
  • SUN-8399
  • 4-[4-[4-(2-Pyrimidinyl)-1-piperazinyl]butyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
CAS registry number： 131112-58-8
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