Water → 4-(1,2-Dimethylimidazol-5-yl)-2-(4-(fluorosulphonyl)anilino)pyrimidine
Reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[Cs+:5].[Cs+:6].[I:21][c:22]1[cH:23][cH:24][c:25]([S:28](=[O:29])(=[O:30])[F:31])[cH:26][cH:27]1.[NH2:7][c:8]1[n:9][cH:10][cH:11][c:12](-[c:14]2[cH:15][n:16][c:17]([CH3:20])[n:18]2[CH3:19])[n:13]1.[O:104]=[C:105]([CH:106]=[CH:107][c:108]1[cH:109][cH:110][cH:111][cH:112][cH:113]1)[CH:114]=[CH:115][c:116]1[cH:117][cH:118][cH:119][cH:120][cH:121]1.[O:122]=[C:123]([CH:124]=[CH:125][c:126]1[cH:127][cH:128][cH:129][cH:130][cH:131]1)[CH:132]=[CH:133][c:134]1[cH:135][cH:136][cH:137][cH:138][cH:139]1.[O:78]1[CH2:79][CH2:80][O:81][CH2:82][CH2:83]1.[O:86]=[C:87]([CH:88]=[CH:89][c:90]1[cH:91][cH:92][cH:93][cH:94][cH:95]1)[CH:96]=[CH:97][c:98]1[cH:99][cH:100][cH:101][cH:102][cH:103]1.[OH2:140].[Pd:84].[Pd:85].[c:32]1([P:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[c:40]2[cH:41][cH:42][c:43]3[c:44]([cH:45][cH:46][cH:47][cH:48]3)[c:49]2-[c:50]2[c:51]3[c:52]([cH:53][cH:54][cH:55][cH:56]3)[cH:57][cH:58][c:59]2[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)[cH:73][cH:74][cH:75][cH:76][cH:77]1>>[NH:7]([c:8]1[n:9][cH:10][cH:11][c:12](-[c:14]2[cH:15][n:16][c:17]([CH3:20])[n:18]2[CH3:19])[n:13]1)[c:22]1[cH:23][cH:24][c:25]([S:28](=[O:29])(=[O:30])[F:31])[cH:26][cH:27]1Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-27fe071378e54dd6bbd428d1db2f0233
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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