Acetic Acid → 9-Chloro-5-hydroxy-3-methyl-7-phenyl-5H-pyrimido[4,5-d][2]benzazepin-1(2H)-one
Reaction equation
[C:1](=[O:2])([CH3:3])[O:4][CH:5]1[N:6]=[C:7]([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:8]2[c:9]([cH:18][cH:19][c:20]([Cl:22])[cH:21]2)-[c:10]2[c:11]1[n:12][c:13]([CH3:17])[nH:14][c:15]2=[O:16].[CH3:31][C:32](=[O:33])[OH:34].[Na+:30].[OH-:29].[OH2:35]>>[OH:4][CH:5]1[N:6]=[C:7]([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:8]2[c:9]([cH:18][cH:19][c:20]([Cl:22])[cH:21]2)-[c:10]2[c:11]1[n:12][c:13]([CH3:17])[nH:14][c:15]2=[O:16]Participants
6
Sources & evidence
- ORD record
- ord-ad13a415dbf747f7b27c346f61b22ca7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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