Hydrochloric Acid → (2-(4-hydroxy-2,6-dimethyl-phenyl)-1-{isopropyl-[1-(4-phenyl-1H-imidazol-2-yl)-ethyl]-carbamoyl}-ethyl)-carbamic acid tert-butyl ester
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:11])[OH:12])[CH2:13][c:14]1[c:15]([CH3:22])[cH:16][c:17]([OH:21])[cH:18][c:19]1[CH3:20].[CH3:51][N:52]([CH3:53])[CH2:54][CH2:55][CH2:56][N:57]=[C:58]=[N:59][CH2:60][CH3:61].[CH:23]([CH3:24])([CH3:25])[NH:26][CH:27]([CH3:28])[c:29]1[nH:30][cH:31][c:32](-[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[n:33]1.[ClH:50].[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[OH:40][n:41]1[c:42]2[cH:43][cH:44][cH:45][cH:46][c:47]2[n:48][n:49]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:12])[N:26]([CH:23]([CH3:24])[CH3:25])[CH:27]([CH3:28])[c:29]1[nH:30][cH:31][c:32](-[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[n:33]1)[CH2:13][c:14]1[c:15]([CH3:22])[cH:16][c:17]([OH:21])[cH:18][c:19]1[CH3:20]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-ab23542047e042f69a995396a706a0a8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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