Chem
J-GLOBAL ID：201107023645045937   Nikkaji number：J2.935.208I

2-(4-Methoxyanilino)-4-methylpyrimidine-1,5(6H)-dicarboxylic acid 1-tert-butyl 5-ethyl ester

2-(4-メトキシアニリノ)-4-メチルピリミジン-1,5(6H)-ジカルボン酸1-tert-ブチル5-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： C20H27N3O5
Molecular formula furigana： C20-H27-N3-O5
Molecular weight： 389.452
InChI： InChI=1S/C20H27N3O5/c1-7-27-17(24)16-12-23(19(25)28-20(3,4)5)18(21-13(16)2)22-14-8-10-15(26-6)11-9-14/h8-11H,7,12H2,1-6H3,(H,21,22)
InChI key： IFDXGLJQROMASK-UHFFFAOYSA-N
SMILES： CCOC(=O)C1=C(C)N=C(Nc2ccc(OC)cc2)N(C1)C(=O)OC(C)(C)C
Systematic name  (3)：
  • 2-(4-メトキシアニリノ)-4-メチルピリミジン-1,5(6H)-ジカルボン酸1-tert-ブチル5-エチル
  • 1-tert-ブチル 5-エチル 2-[(4-メトキシフェニル)アミノ]-4-メチル-1,6-ジヒドロピリミジン-1,5-ジカルボキシラート
  • 1-tert-butyl 5-ethyl 2-[(4-methoxyphenyl)amino]-4-methyl-1,6-dihydropyrimidine-1,5-dicarboxylate
Other name (1)：
  • 2-(4-Methoxyanilino)-4-methylpyrimidine-1,5(6H)-dicarboxylic acid 1-tert-butyl 5-ethyl ester
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