Chem
J-GLOBAL ID:201807004802207528   Nikkaji number:J3.706.652D

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

2-アニリノ-5-ペンタノイル-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: C20H27N3O3
Molecular formula furigana: C20-H27-N3-O3
Molecular weight: 357.454
InChI: InChI=1S/C20H27N3O3/c1-5-6-12-17(24)15-13-21-18(22-16-10-8-7-9-11-16)23(14-15)19(25)26-20(2,3)4/h7-11,13H,5-6,12,14H2,1-4H3,(H,21,22)
InChI key: XIWRKYBBMNOUDC-UHFFFAOYSA-N
SMILES: CCCCC(=O)C1=CN=C(Nc2ccccc2)N(C1)C(=O)OC(C)(C)C
Systematic name  (5):
  • 2-アニリノ-5-ペンタノイル-ピリミジン-1(6H)-カルボン酸tert-ブチル
  • 2-アニリノ-5-ペンタノイル-1(6H)-ピリミジンカルボン酸tert-ブチル
  • 2-アニリノ-5-ペンタノイル-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 5-ペンタノイル-2-(フェニルアミノ)-1,6-ジヒドロピリミジン-1-カルボキシラート
  • tert-butyl 5-pentanoyl-2-(phenylamino)-1,6-dihydropyrimidine-1-carboxylate
Other name (3):
  • 2-Anilino-5-pentanoyl-pyrimidine-1(6H)-carboxylic acid tert-butyl ester
  • 2-Anilino-5-pentanoyl-1(6H)-pyrimidinecarboxylic acid tert-butyl ester
  • 2-Anilino-5-pentanoyl-1,6-dihydropyrimidine-1-carboxylic acid tert-butyl ester
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