Toluene → 5-chloro-1-(2,4-difluorophenyl)-7-ethyl-1H-pyrazolo[4,3-b]pyrazin-6(7H)-one
Reaction equation
[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[CH:27]([N:28]([CH2:29][CH3:30])[CH:31]([CH3:32])[CH3:33])([CH3:34])[CH3:35].[F:1][c:2]1[c:3](-[n:9]2[n:10][cH:11][c:12]3[c:13]2[n:14]([CH2:20][CH3:21])[c:15](=[O:19])[c:16](=[O:18])[nH:17]3)[cH:4][cH:5][c:6]([F:8])[cH:7]1.[P:22]([Cl:23])([Cl:24])([Cl:25])=[O:26]>>[F:1][c:2]1[c:3](-[n:9]2[n:10][cH:11][c:12]3[c:13]2[n:14]([CH2:20][CH3:21])[c:15](=[O:19])[c:16]([Cl:24])[n:17]3)[cH:4][cH:5][c:6]([F:8])[cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-682d866b572c4616af59cdaff435053d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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