Ethanol → 1-(2-Cyclopropylpyridin-4-yl)-4-fluoro-1-(2-(pyrimidin-5-yl)pyridin-4-yl)-1H-isoindol-3-amine
반응식
[Br:1][c:2]1[n:3][cH:4][cH:5][c:6]([C:8]2([c:19]3[cH:20][c:21]([CH:25]4[CH2:26][CH2:27]4)[n:22][cH:23][cH:24]3)[N:9]=[C:10]([NH2:18])[c:11]3[c:12]([F:17])[cH:13][cH:14][cH:15][c:16]32)[cH:7]1.[C:37](=[O:38])([O-:39])[O-:40].[CH3:43][O:44][CH2:45][CH2:46][O:47][CH3:48].[CH3:49][CH2:50][OH:51].[Cs+:41].[Cs+:42].[OH2:52].[n:28]1[cH:29][n:30][cH:31][c:32]([B:34]([OH:35])[OH:36])[cH:33]1>>[c:2]1(-[c:32]2[cH:31][n:30][cH:29][n:28][cH:33]2)[n:3][cH:4][cH:5][c:6]([C:8]2([c:19]3[cH:20][c:21]([CH:25]4[CH2:26][CH2:27]4)[n:22][cH:23][cH:24]3)[N:9]=[C:10]([NH2:18])[c:11]3[c:12]([F:17])[cH:13][cH:14][cH:15][c:16]32)[cH:7]1참가 물질
8
반응물 7
생성물 1
출처 및 근거
- ORD 기록
- ord-814cb12911f44de0974ccb8be67e9cf0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
반응 노트
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