Acetonitrile → 5-Heptyl-2-[4-[2-[4-(trifluoromethoxy)phenyl]ethenyl]phenyl]pyrimidine
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH3:7])[c:8]1[cH:9][n:10][c:11](-[c:14]2[cH:15][cH:16][c:17]([CH:18]=[CH2:19])[cH:20][cH:21]2)[n:12][cH:13]1.[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH3:63][C:64]#[N:65].[F:22][C:23]([O:24][c:25]1[cH:26][cH:27][c:28]([Br:31])[cH:29][cH:30]1)([F:32])[F:33].[c:41]1([CH3:42])[cH:43][cH:44][cH:45][cH:46][c:47]1[P:48]([c:49]1[cH:50][cH:51][cH:52][cH:53][c:54]1[CH3:55])[c:56]1[cH:57][cH:58][cH:59][cH:60][c:61]1[CH3:62]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH3:7])[c:8]1[cH:9][n:10][c:11](-[c:14]2[cH:15][cH:16][c:17]([CH:18]=[CH:19][c:28]3[cH:27][cH:26][c:25]([O:24][C:23]([F:22])([F:32])[F:33])[cH:30][cH:29]3)[cH:20][cH:21]2)[n:12][cH:13]1Participants
6
Sources & evidence
- ORD record
- ord-21e5abf4574c430a8a5cb10f1607d348
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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