Water → 3-[2-(4-Aminophenyl)ethyl]-8-benzyl-1-propylxanthine
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[n:9][c:10]2[n:11]([CH2:22][CH2:23][c:24]3[cH:25][cH:26][c:27]([N+:30]([O-:31])=[O:32])[cH:28][cH:29]3)[c:12](=[O:21])[n:13]([CH2:18][CH2:19][CH3:20])[c:14](=[O:17])[c:15]2[nH:16]1.[H:36][H:37].[NH2:34][NH2:35].[OH2:33].[Pd:38]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[n:9][c:10]2[n:11]([CH2:22][CH2:23][c:24]3[cH:25][cH:26][c:27]([NH2:30])[cH:28][cH:29]3)[c:12](=[O:21])[n:13]([CH2:18][CH2:19][CH3:20])[c:14](=[O:17])[c:15]2[nH:16]1Participants
6
Sources & evidence
- ORD record
- ord-c4a9589dc0c34d4baa1401e58a670d8b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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