Chloride → 5-(2,5-difluoro-4-methoxyphenyl)-3-methyl-2-(phenylamino)pyrimidin-4(3H)-one
Reaction equation
[Br:1][c:2]1[c:3](=[O:16])[n:4]([CH3:15])[c:5]([NH:8][c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[n:6][cH:7]1.[C:38](=[O:39])([O-:40])[O-:41].[Cl-:31].[F:17][c:18]1[c:19]([B:27]([OH:28])[OH:29])[cH:20][c:21]([F:26])[c:22]([O:24][CH3:25])[cH:23]1.[Li+:30].[Na+:42].[Na+:43].[O:32]1[CH2:33][CH2:34][O:35][CH2:36][CH2:37]1.[cH:44]1[cH:45][cH:46][c:47]([P:48]([Pd:49]([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)([P:69]([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[P:88]([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)([c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)[c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)[cH:119][cH:120]1>>[c:2]1(-[c:19]2[c:18]([F:17])[cH:23][c:22]([O:24][CH3:25])[c:21]([F:26])[cH:20]2)[c:3](=[O:16])[n:4]([CH3:15])[c:5]([NH:8][c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[n:6][cH:7]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-668f6329273c4d818ecc11d2147ecbeb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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