Benzene → 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-3-(2-methylthiazolidine-2-yl)-4-methylsulfinyl-1H-pyrazole
Reaction equation
[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[ClH:25].[NH2:1][c:2]1[c:3]([S:22](=[O:23])[CH3:24])[c:4]([C:19]([CH3:20])=[O:21])[n:5][n:6]1-[c:7]1[c:8]([Cl:18])[cH:9][c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][c:12]1[Cl:13].[NH2:26][CH2:27][CH2:28][SH:29].[OH2:48].[c:37]1([CH3:38])[cH:39][cH:40][c:41]([S:42]([OH:43])(=[O:44])=[O:45])[cH:46][cH:47]1.[cH:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1>>[NH2:1][c:2]1[c:3]([S:22](=[O:23])[CH3:24])[c:4]([C:19]2([CH3:20])[NH:26][CH2:27][CH2:28][S:29]2)[n:5][n:6]1-[c:7]1[c:8]([Cl:18])[cH:9][c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][c:12]1[Cl:13]Participants
8
Sources & evidence
- ORD record
- ord-d6c346237be24ffb93cfa0063c6fcf4e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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