Acetic Acid → 9-chloro-7-(2-chlorophenyl)-6,7-dihydro-5H-pyrimido[5,4-d][2]benzazepine
Reaction equation
[CH2:28]([Cl:29])[Cl:30].[CH3:24][C:25](=[O:26])[OH:27].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:22][cH:23]1)-[c:6]1[c:7]([cH:18][n:19][cH:20][n:21]1)[CH2:8][N:9]=[C:10]2[c:11]1[c:12]([Cl:17])[cH:13][cH:14][cH:15][cH:16]1.[Zn:31]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:22][cH:23]1)-[c:6]1[c:7]([cH:18][n:19][cH:20][n:21]1)[CH2:8][NH:9][CH:10]2[c:11]1[c:12]([Cl:17])[cH:13][cH:14][cH:15][cH:16]1Participants
5
Sources & evidence
- ORD record
- ord-51e640c7917642cdad6b3f4883e0fd00
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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