Hydrochloric Acid → 3-(4-{1-[3-(2,4-Difluoro-phenyl)-1-heptyl-ureidomethyl]-cyclopropyl}-phenyl)-2-ethoxy-propionic acid methyl ester
Reaction equation
[CH3:1][O:2][C:3]([CH:4]([CH2:5][c:6]1[cH:7][cH:8][c:9]([C:12]2([CH2:15][NH:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH3:23])[CH2:13][CH2:14]2)[cH:10][cH:11]1)[O:24][CH2:25][CH3:26])=[O:27].[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[CH:39]([N:40]([CH2:41][CH3:42])[CH:43]([CH3:44])[CH3:45])([CH3:46])[CH3:47].[ClH:48].[F:28][c:29]1[c:30]([N:36]=[C:37]=[O:38])[cH:31][cH:32][c:33]([F:35])[cH:34]1>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][c:6]1[cH:7][cH:8][c:9]([C:12]2([CH2:15][N:16]([CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH3:23])[C:37]([NH:36][c:30]3[c:29]([F:28])[cH:34][c:33]([F:35])[cH:32][cH:31]3)=[O:38])[CH2:13][CH2:14]2)[cH:10][cH:11]1)[O:24][CH2:25][CH3:26])=[O:27]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-acb794f56c0f4f5d837e287a31f37e3c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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