Acetate → 4-Bromo-1-{3,5-difluoro-4-[(phenylmethyl)oxy]phenyl}-1H-indazole-6-carbonitrile
Reaction equation
[Br:1][c:2]1[c:3]2[cH:4][n:5][nH:6][c:7]2[cH:8][c:9]([C:11]#[N:12])[cH:10]1.[C:41]([O-:42])(=[O:43])[CH3:44].[C:46]([O-:47])(=[O:48])[CH3:49].[Cl:38][CH2:39][Cl:40].[Cu+2:45].[F:13][c:14]1[cH:15][c:16]([B:29]([OH:30])[OH:31])[cH:17][c:18]([F:28])[c:19]1[O:20][CH2:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1.[cH:32]1[cH:33][cH:34][n:35][cH:36][cH:37]1>>[Br:1][c:2]1[c:3]2[cH:4][n:5][n:6](-[c:16]3[cH:15][c:14]([F:13])[c:19]([O:20][CH2:21][c:22]4[cH:23][cH:24][cH:25][cH:26][cH:27]4)[c:18]([F:28])[cH:17]3)[c:7]2[cH:8][c:9]([C:11]#[N:12])[cH:10]1Participants
7
Sources & evidence
- ORD record
- ord-929560ad10404d7ab436debbe04767fe
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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