Sodium ion → 1-(4-(5-(1H-Pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-ylamino)phenyl)piperazin-2-one
Reaction equation
[Br:28][c:29]1[cH:30][n:31][c:32]([NH:38][c:39]2[cH:40][cH:41][c:42]([N:45]3[C:46](=[O:51])[CH2:47][NH:48][CH2:49][CH2:50]3)[cH:43][cH:44]2)[c:33]2[n:34]1[n:35][cH:36][n:37]2.[CH3:52][C:53]([CH3:54])([O-:55])[CH3:56].[Na+:57].[O:1]1[CH2:2][CH2:3][N:4]([c:5]2[cH:6][cH:7][c:8]([NH:9][c:10]3[c:11]4[n:12]([n:13][cH:14][n:15]4)[c:16](-[c:20]4[cH:21][n:22][nH:23][cH:24]4)[cH:17][n:18]3)[cH:19][cH:25]2)[CH2:26][CH2:27]1.[O:58]=[CH:59][N:60]([CH3:61])[CH3:62].[OH2:63].[cH:64]1[cH:65][cH:66][c:67]([P:68]([Pd:69]([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)([P:89]([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[P:108]([c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)([c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[c:121]2[cH:122][cH:123][cH:124][cH:125][cH:126]2)([c:127]2[cH:128][cH:129][cH:130][cH:131][cH:132]2)[c:133]2[cH:134][cH:135][cH:136][cH:137][cH:138]2)[cH:139][cH:140]1>>[c:20]1(-[c:29]2[cH:30][n:31][c:32]([NH:38][c:39]3[cH:40][cH:41][c:42]([N:45]4[C:46](=[O:51])[CH2:47][NH:48][CH2:49][CH2:50]4)[cH:43][cH:44]3)[c:33]3[n:34]2[n:35][cH:36][n:37]3)[cH:21][nH:22][n:23][cH:24]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-1b467157b9c04ebc9f672343d2a9823f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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