Sodium ion → 3-(methylthio)-9-pentyl-6,9-dihydro-5H-[1,2,4]triazolo[4,3-a]purin-5-one
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[n:6]1[c:7]2[n:8]([c:9](=[O:15])[c:10]3[nH:11][cH:12][n:13][c:14]13)[c:16](=[S:19])[nH:17][n:18]2.[CH3:20][O:21][S:22]([O:23][CH3:24])(=[O:25])=[O:26].[Na+:28].[OH-:27].[OH2:29]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[n:6]1[c:7]2[n:8]([c:9](=[O:15])[c:10]3[nH:11][cH:12][n:13][c:14]13)[c:16]([S:19][CH3:20])[n:17][n:18]2Participants
6
Sources & evidence
- ORD record
- ord-72caa85ac3b446329f9215c4b770e2bf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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