Acetic Acid → 6-Pentyl-6,9-dihydro-5H-[1,2,4]triazolo[3,4-i]purin-5-one
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[cH:9][n:10][c:11]2[n:12]([CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])[c:13](=[O:20])[n:14]3[c:15]([c:16]12)[n:17][n:18][cH:19]3.[CH3:27][C:28](=[O:29])[OH:30].[ClH:26].[OH-:31].[OH-:33].[Pd+2:32]>>[nH:8]1[cH:9][n:10][c:11]2[n:12]([CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])[c:13](=[O:20])[n:14]3[c:15]([c:16]12)[n:17][n:18][cH:19]3Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-f0788eda6ba64ad2bea9c31b544ffc34
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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