Toluene → 4-(2,3-Difluoro-phenylthiocarbamoyl)-1-methanesulfonyl-1H-pyrrole-2-carboxylic acid methyl ester
Reaction equation
[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6]([S:21](=[O:22])(=[O:23])[CH3:24])[cH:7][c:8]([C:10]([NH:11][c:12]2[c:13]([F:19])[c:14]([F:18])[cH:15][cH:16][cH:17]2)=[O:20])[cH:9]1.[CH3:25][O:26][c:27]1[cH:28][cH:29][c:30]([P:31]2(=[S:34])[S:32][P:33]([c:35]3[cH:36][cH:37][c:38]([O:39][CH3:40])[cH:41][cH:42]3)(=[S:43])[S:44]2)[cH:45][cH:46]1.[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6]([S:21](=[O:22])(=[O:23])[CH3:24])[cH:7][c:8]([C:10]([NH:11][c:12]2[c:13]([F:19])[c:14]([F:18])[cH:15][cH:16][cH:17]2)=[S:34])[cH:9]1Participants
4
Sources & evidence
- ORD record
- ord-82506d2b7f484544b42712660171ade2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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