Dichloromethane → (2,4-Dichloro-6-(2-(isopropylsulfonyl)phenylamino)pyrimidin-5-yl)(phenyl)methanone
Reaction equation
[Cl:1][c:2]1[n:3][c:4]([NH:17][c:18]2[c:19]([S:24](=[O:25])(=[O:26])[CH:27]([CH3:28])[CH3:29])[cH:20][cH:21][cH:22][cH:23]2)[c:5]([CH:9]([OH:10])[c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[c:6]([Cl:8])[n:7]1.[Cl:51][CH2:52][Cl:53].[Cr:30]([O:31][Cr:32]([O-:33])(=[O:34])=[O:35])([O-:36])(=[O:37])=[O:38].[nH+:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[nH+:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[Cl:1][c:2]1[n:3][c:4]([NH:17][c:18]2[c:19]([S:24](=[O:25])(=[O:26])[CH:27]([CH3:28])[CH3:29])[cH:20][cH:21][cH:22][cH:23]2)[c:5]([C:9](=[O:10])[c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[c:6]([Cl:8])[n:7]1Participants
5
Sources & evidence
- ORD record
- ord-3b9ec398077e4503a9ae118bb597f8cf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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