Acetic Acid → 9-Butyl-8-(2-iodo-5-methoxy-benzyl)-9H-purin-6-ylamine
Reaction equation
[C:47]([OH:48])(=[O:49])[CH3:50].[CH2:1]([CH2:2][CH2:3][CH3:4])[n:5]1[c:6]2[n:7][cH:8][n:9][c:10]([NH2:23])[c:11]2[n:12][c:13]1[CH2:14][c:15]1[cH:16][c:17]([O:21][CH3:22])[cH:18][cH:19][cH:20]1.[Cl:51][CH2:52][Cl:53].[I:24][NH:25][C:26](=[O:27])[CH2:28][CH2:29][C:30]([NH2:31])=[O:32].[K+:41].[K+:42].[O-:43][C:44]([O-:45])=[O:46].[O:33]=[C:34]1[N:35]([I:36])[C:37](=[O:38])[CH2:39][CH2:40]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[n:5]1[c:6]2[n:7][cH:8][n:9][c:10]([NH2:23])[c:11]2[n:12][c:13]1[CH2:14][c:15]1[cH:16][c:17]([O:21][CH3:22])[cH:18][cH:19][c:20]1[I:24]Participants
8
Sources & evidence
- ORD record
- ord-8bbf8da56b614a7e93949aceeb8c8c06
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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