Chem
J-GLOBAL ID：200907066750279725   Nikkaji number：J1.241.268A

SUN-N4057

SUN-N4057
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： C23H25N3O2
Molecular formula furigana： C23-H25-N3-O2
Molecular weight： 375.472
InChI： InChI=1S/C23H25N3O2/c27-23-20-7-1-2-9-22(20)28-18-17-26(23)14-6-5-13-25-15-10-19(11-16-25)21-8-3-4-12-24-21/h1-4,7-10,12,17-18H,5-6,11,13-16H2
InChI key： IGSVXGVOMBZHQH-UHFFFAOYSA-N
SMILES： O=C1N(CCCCN2CCC(=CC2)c2ccccn2)C=COc2ccccc12
Systematic name  (3)：
  • 4-[4-[4-(2-ピリジニル)-1,2,3,6-テトラヒドロピリジン-1-イル]ブチル]-1,4-ベンゾオキサゼピン-5(4H)-オン
  • 4-(4-{1',2',3',6'-テトラヒドロ-[2,4'-ビピリジン]-1'-イル}ブチル)-4,5-ジヒドロ-1,4-ベンゾオキサゼピン-5-オン
  • 4-(4-{1',2',3',6'-tetrahydro-[2,4'-bipyridin]-1'-yl}butyl)-4,5-dihydro-1,4-benzoxazepin-5-one
Other name (4)：
  • 4-[4-[4-(2-Pyridinyl)-1,2,3,6-tetrahydropyridine-1-yl]butyl]-1,4-benzoxazepine-5(4H)-one
  • SUN-N4057
  • ピクロゾタン
  • Piclozotan
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