Acetone → 3-(3-(2,6-dimethylphenylamino)-6-(phenylamino)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)propanal
Reaction equation
[CH3:1][c:2]1[c:3]([NH:9][c:10]2[n:11][n:12]([CH2:26][CH2:27][CH:28]([CH2:29][OH:30])[OH:31])[c:13]3[n:14][c:15]([NH:19][c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[n:16][cH:17][c:18]23)[c:4]([CH3:8])[cH:5][cH:6][cH:7]1.[CH3:32][C:33](=[O:34])[CH3:35].[Cl:37][CH2:38][Cl:39].[OH2:36]>>[CH3:1][c:2]1[c:3]([NH:9][c:10]2[n:11][n:12]([CH2:26][CH2:27][CH:28]=[O:31])[c:13]3[n:14][c:15]([NH:19][c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[n:16][cH:17][c:18]23)[c:4]([CH3:8])[cH:5][cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-13636d3c4ae949d4b84b05bba1b4efe0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…