Chem
J-GLOBAL ID:200907046241238997   Nikkaji number:J476.424B

4-(4-シアノフェニル)-2-フェニル-6-メチルピリミジン-5-カルボン酸エチル

4-(4-シアノフェニル)-2-フェニル-6-メチルピリミジン-5-カルボン酸エチル
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: C21H17N3O2
Molecular formula furigana: C21-H17-N3-O2
Molecular weight: 343.386
InChI: InChI=1S/C21H17N3O2/c1-3-26-21(25)18-14(2)23-20(17-7-5-4-6-8-17)24-19(18)16-11-9-15(13-22)10-12-16/h4-12H,3H2,1-2H3
InChI key: XEOLTVBEHGLQAJ-UHFFFAOYSA-N
SMILES: CCOC(=O)c1c(C)nc(nc1c1ccc(cc1)C#N)c1ccccc1
Systematic name  (3):
  • 4-(4-シアノフェニル)-2-フェニル-6-メチルピリミジン-5-カルボン酸エチル
  • エチル 4-(4-シアノフェニル)-6-メチル-2-フェニルピリミジン-5-カルボキシラート
  • ethyl 4-(4-cyanophenyl)-6-methyl-2-phenylpyrimidine-5-carboxylate
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