1,3-Dichloro-2-isocyanatobenzene → 3-(2,6-Dichloro-phenyl)-1-[6-(2,4-difluoro-phenylamino)-pyrimidin-4-yl]-1-methyl-urea

반응식

[Cl:18][c:19]1[c:20]([N:26]=[C:27]=[O:28])[c:21]([Cl:25])[cH:22][cH:23][cH:24]1.[F:1][c:2]1[c:3]([NH:9][c:10]2[n:11][cH:12][n:13][c:14]([NH:16][CH3:17])[cH:15]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1>>[F:1][c:2]1[c:3]([NH:9][c:10]2[n:11][cH:12][n:13][c:14]([N:16]([CH3:17])[C:27]([NH:26][c:20]3[c:19]([Cl:18])[cH:24][cH:23][cH:22][c:21]3[Cl:25])=[O:28])[cH:15]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1

참가 물질

반응물 2

HCID 6045371,3-Dichloro-2-isocyanatobenzene

HCID 66669984N4-(2,4-difluorophenyl)-N6-methylpyrimidine-4,6-diamine

생성물 1

HCID 577102263-(2,6-Dichloro-phenyl)-1-[6-(2,4-difluoro-phenylamino)-pyrimidin-4-yl]-1-methyl-urea

출처 및 근거

ORD 기록: ord-7d61105b49e74b08a331308a6335fc42
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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