Chem
J-GLOBAL ID：201807018145803167   Nikkaji number：J3.706.653B

2-Anilino-5-(phenylpropinoyl)-1(6H)-pyrimidinecarboxylic acid tert-butyl ester

2-アニリノ-5-(フェニルプロピノイル)-1(6H)-ピリミジンカルボン酸tert-ブチル
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： C24H23N3O3
Molecular formula furigana： C24-H23-N3-O3
Molecular weight： 401.466
InChI： InChI=1S/C24H23N3O3/c1-24(2,3)30-23(29)27-17-19(21(28)15-14-18-10-6-4-7-11-18)16-25-22(27)26-20-12-8-5-9-13-20/h4-13,16H,17H2,1-3H3,(H,25,26)
InChI key： FCOBRWRNUVIJIH-UHFFFAOYSA-N
SMILES： CC(C)(C)OC(=O)N1CC(=CN=C1Nc1ccccc1)C(=O)C#Cc1ccccc1
Systematic name  (5)：
  • 2-アニリノ-5-(フェニルプロピノイル)-ピリミジン-1(6H)-カルボン酸tert-ブチル
  • 2-アニリノ-5-(フェニルプロピノイル)-1(6H)-ピリミジンカルボン酸tert-ブチル
  • 2-アニリノ-5-(1-オキソ-3-フェニルプロパルギル)-1,6-ジヒドロピリミジン-1-カルボン酸tert-ブチル
  • tert-ブチル 2-(フェニルアミノ)-5-(3-フェニルプロパ-2-イノイル)-1,6-ジヒドロピリミジン-1-カルボキシラート
  • tert-butyl 2-(phenylamino)-5-(3-phenylprop-2-ynoyl)-1,6-dihydropyrimidine-1-carboxylate
Other name (3)：
  • 2-Anilino-5-(phenylpropinoyl)-pyrimidine-1(6H)-carboxylic acid tert-butyl ester
  • 2-Anilino-5-(phenylpropinoyl)-1(6H)-pyrimidinecarboxylic acid tert-butyl ester
  • 2-Anilino-5-(1-oxo-3-phenylpropargyl)-1,6-dihydropyrimidine-1-carboxylic acid tert-butyl ester
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