Water → 4-Fluoro-1-{4-[2-(2-hydroxy-phenyl)-7-methyl-quinazolin-4-yl]-piperazin-1-yl}-4-methyl-pent-2-en-1-one
Reaction equation
[CH2:33]([N:34]([S:35]([F:36])([F:37])[F:39])[CH2:38][CH3:40])[CH3:41].[Cl:42][CH2:43][Cl:44].[OH2:45].[OH:1][C:2]([CH:3]=[CH:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][N:10]([c:13]2[n:14][c:15](-[c:24]3[c:25]([OH:30])[cH:26][cH:27][cH:28][cH:29]3)[n:16][c:17]3[cH:18][c:19]([CH3:23])[cH:20][cH:21][c:22]23)[CH2:11][CH2:12]1)([CH3:31])[CH3:32]>>[C:2]([CH:3]=[CH:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][N:10]([c:13]2[n:14][c:15](-[c:24]3[c:25]([OH:30])[cH:26][cH:27][cH:28][cH:29]3)[n:16][c:17]3[cH:18][c:19]([CH3:23])[cH:20][cH:21][c:22]23)[CH2:11][CH2:12]1)([CH3:31])([CH3:32])[F:39]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-5288b4e3235440d6ae8aed8cdcdc5621
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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