Water → 5-(N-methyl-N-benzoylamino)-1-[4-(2-methylbenzoylamino)benzoyl]-2,3,4,5-tetrahydro-1H-benzazepine
Reaction equation
[C:39]([c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1)(=[O:46])[Cl:47].[CH3:1][NH:2][CH:3]1[CH2:4][CH2:5][CH2:6][N:7]([C:14]([c:15]2[cH:16][cH:17][c:18]([NH:21][C:22]([c:23]3[c:24]([CH3:29])[cH:25][cH:26][cH:27][cH:28]3)=[O:30])[cH:19][cH:20]2)=[O:31])[c:8]2[c:9]1[cH:10][cH:11][cH:12][cH:13]2.[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[Cl:49][CH2:50][Cl:51].[OH2:48]>>[CH3:1][N:2]([CH:3]1[CH2:4][CH2:5][CH2:6][N:7]([C:14]([c:15]2[cH:16][cH:17][c:18]([NH:21][C:22]([c:23]3[c:24]([CH3:29])[cH:25][cH:26][cH:27][cH:28]3)=[O:30])[cH:19][cH:20]2)=[O:31])[c:8]2[c:9]1[cH:10][cH:11][cH:12][cH:13]2)[C:39]([c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1)=[O:46]Participants
6
Sources & evidence
- ORD record
- ord-7f9443f75487486da00637a0b4bb2108
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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