Benzene → 4-(2-Chloro-5-methylpyridin-4-yl)-1-(2,4,6-trimethylbenzensulfonyl)-1H-pyrrole-2-carboxylic acid methyl ester
Reaction equation
[Br:31][c:32]1[cH:33][c:34]([Cl:39])[n:35][cH:36][c:37]1[CH3:38].[C:42](=[O:43])([O-:44])[O-:45].[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6]([S:19](=[O:20])(=[O:21])[c:22]2[c:23]([CH3:30])[cH:24][c:25]([CH3:29])[cH:26][c:27]2[CH3:28])[cH:7][c:8]([B:10]2[O:11][C:12]([CH3:13])([CH3:14])[C:15]([CH3:16])([CH3:17])[O:18]2)[cH:9]1.[CH3:40][OH:41].[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[Na+:46].[Na+:47].[cH:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[cH:60]1[cH:61][cH:62][c:63]([P:64]([Pd:65]([P:66]([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)[c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)([P:85]([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)[c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)[P:104]([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)[c:129]2[cH:130][cH:131][cH:132][cH:133][cH:134]2)[cH:135][cH:136]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6]([S:19](=[O:20])(=[O:21])[c:22]2[c:23]([CH3:30])[cH:24][c:25]([CH3:29])[cH:26][c:27]2[CH3:28])[cH:7][c:8](-[c:32]2[cH:33][c:34]([Cl:39])[n:35][cH:36][c:37]2[CH3:38])[cH:9]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-3609d8fb16ce49038e965792355212dd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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