Water → 3-{[4-({4-[(Trifluoromethyl)oxy]phenyl}sulfonyl)-1-piperazinyl]carbonyl}pyrazolo[1,5-a]pyrimidine
Reaction equation
[CH:68]([N:69]([CH2:70][CH3:71])[CH:72]([CH3:73])[CH3:74])([CH3:75])[CH3:76].[F:1][C:2]([O:3][c:4]1[cH:5][cH:6][c:7]([S:10](=[O:11])(=[O:12])[N:13]2[CH2:14][CH2:15][NH:16][CH2:17][CH2:18]2)[cH:8][cH:9]1)([F:19])[F:20].[O:77]=[CH:78][N:79]([CH3:80])[CH3:81].[OH2:43].[OH:33][n:34]1[c:35]2[c:36]([cH:37][cH:38][cH:39][cH:40]2)[n:41][n:42]1.[P-:44]([F:45])([F:46])([F:47])([F:48])([F:49])[F:50].[n:21]1[cH:22][c:23]([C:30](=[O:31])[OH:32])[c:24]2[n:25]1[cH:26][cH:27][cH:28][n:29]2.[n:51]1([O:52][C:53]([N:54]([CH3:55])[CH3:56])=[N+:57]([CH3:58])[CH3:59])[c:60]2[cH:61][cH:62][cH:63][cH:64][c:65]2[n:66][n:67]1>>[F:1][C:2]([O:3][c:4]1[cH:5][cH:6][c:7]([S:10](=[O:11])(=[O:12])[N:13]2[CH2:14][CH2:15][N:16]([C:30]([c:23]3[cH:22][n:21][n:25]4[c:24]3[n:29][cH:28][cH:27][cH:26]4)=[O:31])[CH2:17][CH2:18]2)[cH:8][cH:9]1)([F:19])[F:20]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-7159139c51754e1bb1a73bb603d6a9ca
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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