5-bromo-2-(4-methyl-1H-imidazol-1-yl)benzonitrile → HCID 59324064, compound
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5](-[n:10]2[cH:11][n:12][c:13]([CH3:15])[cH:14]2)[c:6]([C:7]#[N:8])[cH:9]1.[F:16][c:17]1[cH:18][cH:19][c:20](-[n:23]2[n:24][c:25]([NH2:29])[n:26][c:27]2[CH3:28])[cH:21][cH:22]1>>[c:2]1([NH:29][c:25]2[n:24][n:23](-[c:20]3[cH:19][cH:18][c:17]([F:16])[cH:22][cH:21]3)[c:27]([CH3:28])[n:26]2)[cH:3][cH:4][c:5](-[n:10]2[cH:11][n:12][c:13]([CH3:15])[cH:14]2)[c:6]([C:7]#[N:8])[cH:9]1Participants
3
Sources & evidence
- ORD record
- ord-928772ae3bd343e48fb29036948250b1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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