Toluene → 1,3-Dimethyl-5-[4-(2-isopropyl-6-methylpyrimidin-4-yloxy)phenylcarbamoyl]barbituric acid
Reaction equation
[CH3:1][N:2]1[C:3](=[O:4])[N:5]([CH3:16])[C:6](=[O:7])[CH:8]([C:11]([O:13][CH2:12][CH3:14])=[O:15])[C:9]1=[O:10].[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[CH:17]([CH3:18])([CH3:19])[c:20]1[n:21][c:22]([CH3:34])[cH:23][c:24]([O:26][c:27]2[cH:28][cH:29][c:30]([NH2:31])[cH:32][cH:33]2)[n:25]1>>[CH3:1][N:2]1[C:3](=[O:4])[N:5]([CH3:16])[C:6](=[O:7])[CH:8]([C:11](=[O:13])[NH:31][c:30]2[cH:29][cH:28][c:27]([O:26][c:24]3[cH:23][c:22]([CH3:34])[n:21][c:20]([CH:17]([CH3:18])[CH3:19])[n:25]3)[cH:33][cH:32]2)[C:9]1=[O:10]Participants
4
Sources & evidence
- ORD record
- ord-7bd4115e29074e5c91d47c5f15aa2637
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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