Hydrochloric Acid → 3-(4-{2-[3-(2,4-Difluoro-phenyl)-1-heptyl-ureido]-ethyl}-phenyl)-2,2-dimethyl-propionic acid
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH3:7])[NH:8][CH2:9][CH2:10][c:11]1[cH:12][cH:13][c:14]([CH2:17][C:18]([C:19](=[O:20])[OH:21])([CH3:22])[CH3:23])[cH:15][cH:16]1.[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[CH:24]([N:25]([CH2:26][CH3:27])[CH:28]([CH3:29])[CH3:30])([CH3:31])[CH3:32].[ClH:44].[F:33][c:34]1[c:35]([N:41]=[C:42]=[O:43])[cH:36][cH:37][c:38]([F:40])[cH:39]1>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH3:7])[N:8]([CH2:9][CH2:10][c:11]1[cH:12][cH:13][c:14]([CH2:17][C:18]([C:19](=[O:20])[OH:21])([CH3:22])[CH3:23])[cH:15][cH:16]1)[C:42]([NH:41][c:35]1[c:34]([F:33])[cH:39][c:38]([F:40])[cH:37][cH:36]1)=[O:43]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-5d8965fff2444c2db828a9b654209cc3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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