Chem
J-GLOBAL ID：200907058632856510   Nikkaji number：J1.819.587I

4-(5-Iodo-4-pyrimidinylamino)benzoic acid methyl ester

4-(5-ヨード-4-ピリミジニルアミノ)安息香酸メチル
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： C12H10IN3O2
Molecular formula furigana： C12-H10-I-N3-O2
Molecular weight： 355.135
InChI： InChI=1S/C12H10IN3O2/c1-18-12(17)8-2-4-9(5-3-8)16-11-10(13)6-14-7-15-11/h2-7H,1H3,(H,14,15,16)
InChI key： NEXNMPADWYPUJE-UHFFFAOYSA-N
SMILES： COC(=O)c1ccc(Nc2ncncc2I)cc1
Systematic name  (3)：
  • 4-(5-ヨード-4-ピリミジニルアミノ)安息香酸メチル
  • メチル 4-[(5-ヨードピリミジン-4-イル)アミノ]ベンゾアート
  • methyl 4-[(5-iodopyrimidin-4-yl)amino]benzoate
Other name (1)：
  • 4-(5-Iodo-4-pyrimidinylamino)benzoic acid methyl ester
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