Chem
J-GLOBAL ID：201207046132535626   Nikkaji number：J3.045.352B

5-(4-Chlorobenzoyl)-2-phenyl-3,4-dihydropyrimidine-3-carboxylic acid tert-butyl ester

5-(4-クロロベンゾイル)-2-フェニル-3,4-ジヒドロピリミジン-3-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： C22H21ClN2O3
Molecular formula furigana： C22-H21-CL-N2-O3
Molecular weight： 396.870
InChI： InChI=1S/C22H21ClN2O3/c1-22(2,3)28-21(27)25-14-17(19(26)15-9-11-18(23)12-10-15)13-24-20(25)16-7-5-4-6-8-16/h4-13H,14H2,1-3H3
InChI key： TWXVVNKOBWQOIH-UHFFFAOYSA-N
SMILES： CC(C)(C)OC(=O)N1CC(=CN=C1c1ccccc1)C(=O)c1ccc(Cl)cc1
Systematic name  (3)：
  • 5-(4-クロロベンゾイル)-2-フェニル-3,4-ジヒドロピリミジン-3-カルボン酸tert-ブチル
  • tert-ブチル 5-(4-クロロベンゾイル)-2-フェニル-1,6-ジヒドロピリミジン-1-カルボキシラート
  • tert-butyl 5-(4-chlorobenzoyl)-2-phenyl-1,6-dihydropyrimidine-1-carboxylate
Other name (1)：
  • 5-(4-Chlorobenzoyl)-2-phenyl-3,4-dihydropyrimidine-3-carboxylic acid tert-butyl ester
Thsaurus map：
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