Acetate → 4'-{[1-(3-Fluoro-4-methoxyphenyl)-2-methyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl]methyl}biphenyl-2-carbonitrile
Reaction equation
[C:63]([O-:64])(=[O:65])[CH3:66].[C:68]([O-:69])(=[O:70])[CH3:71].[CH3:1][c:2]1[nH:3][c:4](=[O:26])[c:5]([CH2:11][c:12]2[cH:13][cH:14][c:15](-[c:18]3[c:19]([C:24]#[N:25])[cH:20][cH:21][cH:22][cH:23]3)[cH:16][cH:17]2)[c:6]([CH2:8][CH2:9][CH3:10])[n:7]1.[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:57][CH2:58][O:59][C:60](=[O:61])[CH3:62].[Cu+2:67].[F:27][c:28]1[cH:29][c:30]([B:36]([OH:37])[OH:38])[cH:31][cH:32][c:33]1[O:34][CH3:35].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[cH:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1>>[CH3:1][c:2]1[n:3](-[c:30]2[cH:29][c:28]([F:27])[c:33]([O:34][CH3:35])[cH:32][cH:31]2)[c:4](=[O:26])[c:5]([CH2:11][c:12]2[cH:13][cH:14][c:15](-[c:18]3[c:19]([C:24]#[N:25])[cH:20][cH:21][cH:22][cH:23]3)[cH:16][cH:17]2)[c:6]([CH2:8][CH2:9][CH3:10])[n:7]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-f853c5394d124bff8a5e2a27be402444
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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