Chem
J-GLOBAL ID:201307097483158153   Nikkaji number:J3.171.442G

XL-388

5-[4-(3-フルオロ-4-メタンスルホニル-2-メチルベンゾイル)-2,3,4,5-テトラヒドロ-1,4-ベンゾオキサゼピン-7-イル]ピリジン-2-アミン
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: C23H22FN3O4S
Molecular formula furigana: C23-H22-F-N3-O4-S
Molecular weight: 455.500
InChI: InChI=1S/C23H22FN3O4S/c1-14-18(5-7-20(22(14)24)32(2,29)30)23(28)27-9-10-31-19-6-3-15(11-17(19)13-27)16-4-8-21(25)26-12-16/h3-8,11-12H,9-10,13H2,1-2H3,(H2,25,26)
InChI key: LNFBAYSBVQBKFR-UHFFFAOYSA-N
SMILES: Cc1c(F)c(ccc1C(=O)N1CCOc2ccc(cc2C1)c1ccc(N)nc1)S(=O)(=O)C
Systematic name  (3):
  • 5-[4-[3-フルオロ-4-(メチルスルホニル)-2-メチルベンゾイル]-2,3,4,5-テトラヒドロ-1,4-ベンゾオキサゼピン-7-イル]ピリジン-2-アミン
  • 5-[4-(3-フルオロ-4-メタンスルホニル-2-メチルベンゾイル)-2,3,4,5-テトラヒドロ-1,4-ベンゾオキサゼピン-7-イル]ピリジン-2-アミン
  • 5-[4-(3-fluoro-4-methanesulfonyl-2-methylbenzoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]pyridin-2-amine
Other name (2):
  • 5-[4-[3-Fluoro-4-(methylsulfonyl)-2-methylbenzoyl]-2,3,4,5-tetrahydro-1,4-benzooxazepine-7-yl]pyridine-2-amine
  • XL-388
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