Hydrochloric Acid → N-[4-[2-(diethylamino)-2-oxoethyl]phenyl]-3-[5-(4-fluorophenyl)-1-methylpyrazol-4-yl]prop-2-enamide
Reaction equation
[CH2:1]([CH3:2])[NH:3][CH2:4][CH3:5].[CH2:46]([N:47]=[C:48]=[N:49][CH2:50][CH2:51][CH2:52][N:53]([CH3:54])[CH3:55])[CH3:56].[CH3:58][N:59]([CH3:60])[CH:61]=[O:62].[ClH:45].[F:6][c:7]1[cH:8][cH:9][c:10](-[c:13]2[c:14]([CH:19]=[CH:20][C:21](=[O:22])[NH:23][c:24]3[cH:25][cH:26][c:27]([CH2:30][C:31](=[O:32])[OH:33])[cH:28][cH:29]3)[cH:15][n:16][n:17]2[CH3:18])[cH:11][cH:12]1.[OH2:34].[OH2:57].[OH:35][n:36]1[c:37]2[cH:38][cH:39][cH:40][cH:41][c:42]2[n:43][n:44]1>>[CH2:1]([CH3:2])[N:3]([CH2:4][CH3:5])[C:31]([CH2:30][c:27]1[cH:26][cH:25][c:24]([NH:23][C:21]([CH:20]=[CH:19][c:14]2[c:13](-[c:10]3[cH:9][cH:8][c:7]([F:6])[cH:12][cH:11]3)[n:17]([CH3:18])[n:16][cH:15]2)=[O:22])[cH:29][cH:28]1)=[O:32]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-367d1dad18e247318b7a0a0043a1171c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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