Water → 2-[5-Chloro-2-(3-ethyl-9-methoxy-2,3,4,5-tetrahydro-1H-benzo[d]azepin-6-ylamino)-pyrimidin-4-ylamino]-N-methyl-benzamide
Reaction equation
[C:36]12([CH2:37][S:38]([OH:39])(=[O:40])=[O:41])[C:42]([CH3:43])([CH3:44])[CH:45]([CH2:46][CH2:47]1)[CH2:48][C:49]2=[O:50].[CH2:1]([CH3:2])[N:3]1[CH2:4][CH2:5][c:6]2[c:7]([c:10]([NH2:16])[cH:11][cH:12][c:13]2[O:14][CH3:15])[CH2:8][CH2:9]1.[CH:51]([OH:52])([CH3:53])[CH3:54].[Cl:17][c:18]1[n:19][cH:20][c:21]([Cl:35])[c:22]([NH:24][c:25]2[c:26]([C:27](=[O:28])[NH:29][CH3:30])[cH:31][cH:32][cH:33][cH:34]2)[n:23]1.[OH2:55]>>[CH2:1]([CH3:2])[N:3]1[CH2:4][CH2:5][c:6]2[c:7]([c:10]([NH:16][c:18]3[n:19][cH:20][c:21]([Cl:35])[c:22]([NH:24][c:25]4[c:26]([C:27](=[O:28])[NH:29][CH3:30])[cH:31][cH:32][cH:33][cH:34]4)[n:23]3)[cH:11][cH:12][c:13]2[O:14][CH3:15])[CH2:8][CH2:9]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-a29df349353f49d19521cec8d02ff73b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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