Chem
J-GLOBAL ID：201407091518360375   Nikkaji number：J3.317.812C

6-[2-Chloro-4-(dimethylcarbamoyl)anilino]-2-(1-methyl-1H-pyrazole-4-yl)-1H-pyrrolo[3,2-c]pyridine-1-carboxylic acid tert-butyl ester

6-[2-クロロ-4-(ジメチルカルバモイル)アニリノ]-2-(1-メチル-1H-ピラゾール-4-イル)-1H-ピロロ[3,2-c]ピリジン-1-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： C25H27ClN6O3
Molecular formula furigana： C25-H27-CL-N6-O3
Molecular weight： 494.980
InChI： InChI=1S/C25H27ClN6O3/c1-25(2,3)35-24(34)32-20(17-13-28-31(6)14-17)10-16-12-27-22(11-21(16)32)29-19-8-7-15(9-18(19)26)23(33)30(4)5/h7-14H,1-6H3,(H,27,29)
InChI key： KYBALIQJYSWGLI-UHFFFAOYSA-N
SMILES： CN(C)C(=O)c1ccc(Nc2cc3n(C(=O)OC(C)(C)C)c(cc3cn2)c2cnn(C)c2)c(Cl)c1
Systematic name  (3)：
  • 6-[2-クロロ-4-(ジメチルカルバモイル)アニリノ]-2-(1-メチル-1H-ピラゾール-4-イル)-1H-ピロロ[3,2-c]ピリジン-1-カルボン酸tert-ブチル
  • tert-ブチル 6-{[2-クロロ-4-(ジメチルカルバモイル)フェニル]アミノ}-2-(1-メチル-1H-ピラゾール-4-イル)-1H-ピロロ[3,2-c]ピリジン-1-カルボキシラート
  • tert-butyl 6-{[2-chloro-4-(dimethylcarbamoyl)phenyl]amino}-2-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[3,2-c]pyridine-1-carboxylate
Other name (1)：
  • 6-[2-Chloro-4-(dimethylcarbamoyl)anilino]-2-(1-methyl-1H-pyrazole-4-yl)-1H-pyrrolo[3,2-c]pyridine-1-carboxylic acid tert-butyl ester
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