Chem
J-GLOBAL ID：201707019336879421   Nikkaji number：J3.605.549I

N-(3,3-Dimethylbutyl)-2-amino-6-[2-[2-[5-(4-fluorobenzoylamino)-2-pyridinyl]ethyl]phenyl]quinoline-3-propanamide

N-(3,3-ジメチルブチル)-2-アミノ-6-[2-[2-[5-(4-フルオロベンゾイルアミノ)-2-ピリジニル]エチル]フェニル]キノリン-3-プロパンアミド
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： C38H40FN5O2
Molecular formula furigana： C38-H40-F-N5-O2
Molecular weight： 617.769
InChI： InChI=1S/C38H40FN5O2/c1-38(2,3)20-21-41-35(45)19-12-28-23-29-22-27(11-18-34(29)44-36(28)40)33-7-5-4-6-25(33)10-15-31-16-17-32(24-42-31)43-37(46)26-8-13-30(39)14-9-26/h4-9,11,13-14,16-18,22-24H,10,12,15,19-21H2,1-3H3,(H2,40,44)(H,41,45)(H,43,46)
InChI key： RTOUKFMBOVMEOT-UHFFFAOYSA-N
SMILES： CC(C)(C)CCNC(=O)CCc1cc2cc(ccc2nc1N)c1ccccc1CCc1ccc(NC(=O)c2ccc(F)cc2)cn1
Systematic name  (3)：
  • N-(3,3-ジメチルブチル)-2-アミノ-6-[2-[2-[5-(4-フルオロベンゾイルアミノ)-2-ピリジニル]エチル]フェニル]キノリン-3-プロパンアミド
  • N-(6-{2-[2-(2-アミノ-3-{2-[(3,3-ジメチルブチル)カルバモイル]エチル}キノリン-6-イル)フェニル]エチル}ピリジン-3-イル)-4-フルオロベンズアミド
  • N-(6-{2-[2-(2-amino-3-{2-[(3,3-dimethylbutyl)carbamoyl]ethyl}quinolin-6-yl)phenyl]ethyl}pyridin-3-yl)-4-fluorobenzamide
Other name (1)：
  • N-(3,3-Dimethylbutyl)-2-amino-6-[2-[2-[5-(4-fluorobenzoylamino)-2-pyridinyl]ethyl]phenyl]quinoline-3-propanamide
Thsaurus map：
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