N,N-Dimethylaniline → 4-Chloro-1-[4-(methanesulfonyl)phenyl]-1H-pyrazolo[3,4-d]pyrimidine
Reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8](-[n:11]2[n:12][cH:13][c:14]3[c:15]2[n:16][cH:17][n:18][c:19]3[OH:20])[cH:9][cH:10]1.[CH3:21][N:22]([CH3:23])[c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[P:30]([Cl:31])([Cl:32])([Cl:33])=[O:34]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8](-[n:11]2[n:12][cH:13][c:14]3[c:15]2[n:16][cH:17][n:18][c:19]3[Cl:32])[cH:9][cH:10]1Participants
4
Sources & evidence
- ORD record
- ord-ee6a00df3fa04cd79d51ede9be1ed6b5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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