Chem
J-GLOBAL ID：200907042676257246   Nikkaji number：J472.600F

6-Methyl-2-phenyl-4-(3-nitrophenyl)pyrimidin-5-ylcarbamic acid tert-butyl ester

6-メチル-2-フェニル-4-(3-ニトロフェニル)ピリミジン-5-イルカルバミド酸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： C22H22N3[N+]O3[O-]
Molecular formula furigana： C22-H22-N4-O4
Molecular weight： 406.442
InChI： InChI=1S/C22H22N4O4/c1-14-18(25-21(27)30-22(2,3)4)19(16-11-8-12-17(13-16)26(28)29)24-20(23-14)15-9-6-5-7-10-15/h5-13H,1-4H3,(H,25,27)
InChI key： OIJGVRQBDLFTOE-UHFFFAOYSA-N
SMILES： Cc1nc(nc(c2cccc(c2)[N+](=O)[O-])c1NC(=O)OC(C)(C)C)c1ccccc1
Systematic name  (3)：
  • 6-メチル-2-フェニル-4-(3-ニトロフェニル)ピリミジン-5-イルカルバミド酸tert-ブチル
  • tert-ブチル N-[4-メチル-6-(3-ニトロフェニル)-2-フェニルピリミジン-5-イル]カルバマート
  • tert-butyl N-[4-methyl-6-(3-nitrophenyl)-2-phenylpyrimidin-5-yl]carbamate
Other name (1)：
  • 6-Methyl-2-phenyl-4-(3-nitrophenyl)pyrimidin-5-ylcarbamic acid tert-butyl ester
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