Sodium ion → 1-benzenesulfonyl-5-bromo-2-{[cyanomethyl-(toluene-4-sulfonyl)amino]methyl}-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid methyl ester
Reaction equation
[C:28](#[N:29])[CH2:30][NH:31][S:32](=[O:33])(=[O:34])[c:35]1[cH:36][cH:37][c:38]([CH3:41])[cH:39][cH:40]1.[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:3][O:4][C:5](=[O:6])[c:7]1[c:8]([CH2:26][Br:27])[n:9]([S:17](=[O:18])(=[O:19])[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[c:10]2[n:11][cH:12][c:13]([Br:16])[cH:14][c:15]12.[Cl:47][CH2:48][Cl:49].[H-:1].[Na+:2].[Na+:50].[Na+:51].[O-:52][C:53](=[O:54])[O-:55].[OH2:56]>>[CH3:3][O:4][C:5](=[O:6])[c:7]1[c:8]([CH2:26][N:31]([CH2:30][C:28]#[N:29])[S:32](=[O:33])(=[O:34])[c:35]2[cH:36][cH:37][c:38]([CH3:41])[cH:39][cH:40]2)[n:9]([S:17](=[O:18])(=[O:19])[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[c:10]2[n:11][cH:12][c:13]([Br:16])[cH:14][c:15]12Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-8dff536388884e14a6ffccbd611f2ec1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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