Methanol → Biphenyl-4-carboxylic acid {2-[4-(5-amino-2-bromo-benzoyl)-piperazin-1-yl]-2-oxo-ethyl}-amide
Reaction equation
[Br:1][c:2]1[c:3]([C:4](=[O:5])[N:6]2[CH2:7][CH2:8][N:9]([C:12]([CH2:13][NH:14][C:15](=[O:16])[c:17]3[cH:18][cH:19][c:20](-[c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[cH:21][cH:22]3)=[O:29])[CH2:10][CH2:11]2)[cH:30][c:31]([N+:34]([O-:35])=[O:36])[cH:32][cH:33]1.[CH3:39][OH:40].[H:37][H:38]>>[Br:1][c:2]1[c:3]([C:4](=[O:5])[N:6]2[CH2:7][CH2:8][N:9]([C:12]([CH2:13][NH:14][C:15](=[O:16])[c:17]3[cH:18][cH:19][c:20](-[c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[cH:21][cH:22]3)=[O:29])[CH2:10][CH2:11]2)[cH:30][c:31]([NH2:34])[cH:32][cH:33]1Participants
4
Sources & evidence
- ORD record
- ord-294de02681e64f0a8682dc25f6058a28
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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