Hydrochloric Acid → 2-[3-(3-Ethyl-1-methyl-2-oxo-azepan-3-yl)-phenoxy]-4-[2-methyl-5-(2-morpholin-4-yl-ethyl)-imidazol-1-ylmethyl]-benzonitrile
Reaction equation
[Br:39][CH2:40][CH2:41][O:42][CH2:43][CH2:44][Br:45].[CH3:46][C:47]#[N:48].[CH3:49][CH2:50][N:51]([CH2:52][CH3:53])[CH2:54][CH3:55].[ClH:1].[ClH:2].[NH2:3][CH2:4][CH2:5][c:6]1[cH:7][n:8][c:9]([CH3:38])[n:10]1[CH2:11][c:12]1[cH:13][c:14]([O:20][c:21]2[cH:22][c:23]([C:27]3([CH2:36][CH3:37])[C:28](=[O:35])[N:29]([CH3:34])[CH2:30][CH2:31][CH2:32][CH2:33]3)[cH:24][cH:25][cH:26]2)[c:15]([C:16]#[N:17])[cH:18][cH:19]1>>[N:3]1([CH2:4][CH2:5][c:6]2[cH:7][n:8][c:9]([CH3:38])[n:10]2[CH2:11][c:12]2[cH:13][c:14]([O:20][c:21]3[cH:22][c:23]([C:27]4([CH2:36][CH3:37])[C:28](=[O:35])[N:29]([CH3:34])[CH2:30][CH2:31][CH2:32][CH2:33]4)[cH:24][cH:25][cH:26]3)[c:15]([C:16]#[N:17])[cH:18][cH:19]2)[CH2:40][CH2:41][O:42][CH2:43][CH2:44]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-b5fe76de83694f70880666bc776d67ec
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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