Methanol → 2-Methyl-6-[1-[1-[bis(4-fluorophenyl)methyl]piperazin-4-yl]-2-hydroxy-3-propanylthio]purine
Reaction equation
[CH3:3][c:4]1[n:5][c:6]([SH:13])[c:7]2[nH:8][cH:9][n:10][c:11]2[n:12]1.[CH3:40][OH:41].[Cl:14][CH2:15][CH:16]([CH2:17][N:18]1[CH2:19][CH2:20][N:21]([CH:24]([c:25]2[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]2)[c:32]2[cH:33][cH:34][c:35]([F:38])[cH:36][cH:37]2)[CH2:22][CH2:23]1)[OH:39].[Cl:47][CH2:48][Cl:49].[H-:2].[Na+:1].[O:42]=[CH:43][N:44]([CH3:45])[CH3:46]>>[CH3:3][c:4]1[n:5][c:6]([S:13][CH2:15][CH:16]([CH2:17][N:18]2[CH2:19][CH2:20][N:21]([CH:24]([c:25]3[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]3)[c:32]3[cH:33][cH:34][c:35]([F:38])[cH:36][cH:37]3)[CH2:22][CH2:23]2)[OH:39])[c:7]2[nH:8][cH:9][n:10][c:11]2[n:12]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-1d9982f13066441bb820b391c73d8efa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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