Water → Methyl 2-[4-(3,4-dichlorophenyl)-3-methyl-7-oxo-1,4-diazepan-1-yl]-4-phenylmethoxybutanoate
Reaction equation
[CH2:44]([SiH:45]([CH2:46][CH3:47])[CH2:48][CH3:49])[CH3:50].[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH2:6][O:7][CH2:8][c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[N:15]([C:16]([CH2:17][CH:18]([O:19][CH3:20])[O:21][CH3:22])=[O:23])[CH2:24][CH:25]([CH3:26])[NH:27][c:28]1[cH:29][c:30]([Cl:35])[c:31]([Cl:34])[cH:32][cH:33]1)=[O:36].[CH3:51][CH2:52][N:53]([CH2:54][CH3:55])[CH2:56][CH3:57].[CH3:61][CH2:62][O:63][CH2:64][CH3:65].[Cl:58][CH2:59][Cl:60].[OH2:66].[OH:37][C:38]([C:39]([F:40])([F:41])[F:42])=[O:43]>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH2:6][O:7][CH2:8][c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[N:15]1[C:16](=[O:23])[CH2:17][CH2:18][N:27]([c:28]2[cH:29][c:30]([Cl:35])[c:31]([Cl:34])[cH:32][cH:33]2)[CH:25]([CH3:26])[CH2:24]1)=[O:36]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-d5c46980b9d341feb774fa9be9c7a745
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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