1-Bromo-2-isocyanato-4-methoxy-5-methyl-benzene → 4-oxo-3,4-dihydro-2H-[2,3']bipyridinyl-1-carboxylic acid (2-bromo-5-methoxy-4-methyl-phenyl)-amide

반응식

[Br:14][c:15]1[c:16]([N:24]=[C:25]=[O:26])[cH:17][c:18]([O:22][CH3:23])[c:19]([CH3:21])[cH:20]1.[NH:1]1[CH:2]([c:8]2[cH:9][n:10][cH:11][cH:12][cH:13]2)[CH2:3][C:4](=[O:7])[CH:5]=[CH:6]1>>[N:1]1([C:25]([NH:24][c:16]2[c:15]([Br:14])[cH:20][c:19]([CH3:21])[c:18]([O:22][CH3:23])[cH:17]2)=[O:26])[CH:2]([c:8]2[cH:9][n:10][cH:11][cH:12][cH:13]2)[CH2:3][C:4](=[O:7])[CH:5]=[CH:6]1

참가 물질

반응물 2

HCID 593777511-Bromo-2-isocyanato-4-methoxy-5-methyl-benzene

HCID 593777842,3-dihydro-1H-[2,3']bipyridinyl-4-one

생성물 1

HCID 593778044-oxo-3,4-dihydro-2H-[2,3']bipyridinyl-1-carboxylic acid (2-bromo-5-methoxy-4-methyl-phenyl)-amide

출처 및 근거

ORD 기록: ord-eb376fe5df7f4a3dbdf61d23d715d5a7
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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