Sodium ion → 2-(4-{2-(2,6-Dimethylphenyl)-5-[(5-isopropyl-2-methylphenoxy)methyl]-6-methylpyrimidin-4-yl}piperazin-1-yl)acetamide
Reaction equation
[CH3:31][c:32]1[c:33]([B:39]([OH:40])[OH:41])[c:34]([CH3:38])[cH:35][cH:36][cH:37]1.[Cl:1][c:2]1[n:3][c:4]([CH3:30])[c:5]([CH2:18][O:19][c:20]2[c:21]([CH3:29])[cH:22][cH:23][c:24]([CH:26]([CH3:27])[CH3:28])[cH:25]2)[c:6]([N:8]2[CH2:9][CH2:10][N:11]([CH2:14][C:15](=[O:16])[NH2:17])[CH2:12][CH2:13]2)[n:7]1.[Na+:42].[Na+:43].[O-:44][C:45](=[O:46])[O-:47].[O:48]1[CH2:49][CH2:50][O:51][CH2:52][CH2:53]1.[cH:54]1[cH:55][cH:56][c:57]([P:58]([Pd:59]([P:60]([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)([P:79]([c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[P:98]([c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)([c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)[c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)([c:117]2[cH:118][cH:119][cH:120][cH:121][cH:122]2)[c:123]2[cH:124][cH:125][cH:126][cH:127][cH:128]2)[cH:129][cH:130]1>>[c:2]1(-[c:33]2[c:32]([CH3:31])[cH:37][cH:36][cH:35][c:34]2[CH3:38])[n:3][c:4]([CH3:30])[c:5]([CH2:18][O:19][c:20]2[c:21]([CH3:29])[cH:22][cH:23][c:24]([CH:26]([CH3:27])[CH3:28])[cH:25]2)[c:6]([N:8]2[CH2:9][CH2:10][N:11]([CH2:14][C:15](=[O:16])[NH2:17])[CH2:12][CH2:13]2)[n:7]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-e810f5e8568a4d4984ffe8d2f1e20bff
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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