Ethanol → 1-[2-Fluoro-4-(2-{[4-(4-methylpiperazin-1-yl)piperidine-1-carbonyl]amino}pyridin-4-yloxy)phenylcarbamoyl]cyclopropanecarboxylic acid
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[C:11]1([C:14]([NH:15][c:16]2[c:17]([F:45])[cH:18][c:19]([O:22][c:23]3[cH:24][c:25]([NH:29][C:30](=[O:31])[N:32]4[CH2:33][CH2:34][CH:35]([N:38]5[CH2:39][CH2:40][N:41]([CH3:44])[CH2:42][CH2:43]5)[CH2:36][CH2:37]4)[n:26][cH:27][cH:28]3)[cH:20][cH:21]2)=[O:46])[CH2:12][CH2:13]1.[CH3:53][CH2:54][OH:55].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1.[OH2:47]>>[O:8]=[C:9]([OH:10])[C:11]1([C:14]([NH:15][c:16]2[c:17]([F:45])[cH:18][c:19]([O:22][c:23]3[cH:24][c:25]([NH:29][C:30](=[O:31])[N:32]4[CH2:33][CH2:34][CH:35]([N:38]5[CH2:39][CH2:40][N:41]([CH3:44])[CH2:42][CH2:43]5)[CH2:36][CH2:37]4)[n:26][cH:27][cH:28]3)[cH:20][cH:21]2)=[O:46])[CH2:12][CH2:13]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-3a61915680c541d298629a8807afb304
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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