Chem
J-GLOBAL ID：200907045488390418   Nikkaji number：J545.180I

CI-994

CI-994
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： C15H15N3O2
Molecular formula furigana： C15-H15-N3-O2
Molecular weight： 269.304
InChI： InChI=1S/C15H15N3O2/c1-10(19)17-12-8-6-11(7-9-12)15(20)18-14-5-3-2-4-13(14)16/h2-9H,16H2,1H3,(H,17,19)(H,18,20)
InChI key： VAZAPHZUAVEOMC-UHFFFAOYSA-N
SMILES： CC(=O)Nc1ccc(cc1)C(=O)Nc1ccccc1N
Systematic name  (3)：
  • 4-(アセチルアミノ)-N-(2-アミノフェニル)ベンズアミド
  • N-(2-アミノフェニル)-4-アセトアミドベンズアミド
  • N-(2-aminophenyl)-4-acetamidobenzamide
Other name (8)：
  • アセチルジナリン
  • Acetyldinaline
  • CI-994
  • Goe-5549
  • PD-123654
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CAS registry number： 112522-64-2
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