Hydrochloric Acid → 2-(2,4-Dichloro-benzenesulfonylamino)-5-[4-(piperidine-1-sulfonyl)-phenylsulfanyl]-isonicotinic acid
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[O:6][C:7]([c:8]1[cH:9][c:10]([NH:30][S:31](=[O:32])(=[O:33])[c:34]2[c:35]([Cl:41])[cH:36][c:37]([Cl:40])[cH:38][cH:39]2)[n:11][cH:12][c:13]1[S:14][c:15]1[cH:16][cH:17][c:18]([S:21](=[O:22])(=[O:23])[N:24]2[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]2)[cH:19][cH:20]1)=[O:42].[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[ClH:46].[Li+:45].[OH-:44].[OH2:43].[OH2:52]>>[O:6]=[C:7]([c:8]1[cH:9][c:10]([NH:30][S:31](=[O:32])(=[O:33])[c:34]2[c:35]([Cl:41])[cH:36][c:37]([Cl:40])[cH:38][cH:39]2)[n:11][cH:12][c:13]1[S:14][c:15]1[cH:16][cH:17][c:18]([S:21](=[O:22])(=[O:23])[N:24]2[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]2)[cH:19][cH:20]1)[OH:42]Participants
7
Sources & evidence
- ORD record
- ord-831077a3f5bc4f79831b155c1cbe6ed6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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