Hydrochloric Acid → Ethyl 2-[4-[3-[5-(4-fluorophenyl)-1-methylpyrazol-4-yl]prop-2-enoylamino]phenyl]acetate
Reaction equation
[CH2:44]([N:45]=[C:46]=[N:47][CH2:48][CH2:49][CH2:50][N:51]([CH3:52])[CH3:53])[CH3:54].[CH3:56][N:57]([CH3:58])[CH:59]=[O:60].[ClH:43].[F:14][c:15]1[cH:16][cH:17][c:18](-[c:21]2[c:22]([CH:27]=[CH:28][C:29](=[O:30])[OH:31])[cH:23][n:24][n:25]2[CH3:26])[cH:19][cH:20]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][C:9](=[O:10])[O:11][CH2:12][CH3:13])[cH:6][cH:7]1.[OH2:32].[OH2:55].[OH:33][n:34]1[c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]2[n:41][n:42]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([CH2:8][C:9](=[O:10])[O:11][CH2:12][CH3:13])[cH:6][cH:7]1)[C:29]([CH:28]=[CH:27][c:22]1[c:21](-[c:18]2[cH:17][cH:16][c:15]([F:14])[cH:20][cH:19]2)[n:25]([CH3:26])[n:24][cH:23]1)=[O:30]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-842f7dbf9e574eca8c009912f967bfe6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
Loading…