Aniline → 1-(but-3-enyl)-N3-(2,6-dimethylphenyl)-N6-phenyl-1H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
Reaction equation
[CH2:1]([CH2:2][CH:3]=[CH2:4])[n:5]1[n:6][c:7]([NH:15][c:16]2[c:17]([CH3:23])[cH:18][cH:19][cH:20][c:21]2[CH3:22])[c:8]2[c:9]1[n:10][c:11]([Cl:14])[n:12][cH:13]2.[CH2:38]1[O:39][CH2:40][CH2:41][O:42][CH2:43]1.[F:31][C:32]([F:33])([F:34])[C:35]([OH:36])=[O:37].[NH2:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[CH2:1]([CH2:2][CH:3]=[CH2:4])[n:5]1[n:6][c:7]([NH:15][c:16]2[c:17]([CH3:23])[cH:18][cH:19][cH:20][c:21]2[CH3:22])[c:8]2[c:9]1[n:10][c:11]([NH:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[n:12][cH:13]2Participants
5
Sources & evidence
- ORD record
- ord-476d75b095524cec92f81bbe950c32ef
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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