Isopropanol → Benzoic acid, 2-[[2-chloro-7-[(4-methylphenyl)sulfonyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-6-fluoro-
Reaction equation
[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[CH:33]([OH:34])([CH3:35])[CH3:36].[CH:37]([N:38]([CH2:39][CH3:40])[CH:41]([CH3:42])[CH3:43])([CH3:44])[CH3:45].[Cl:1][c:2]1[n:3][c:4]([Cl:21])[c:5]2[c:6]([n:7]1)[n:8]([S:11](=[O:12])(=[O:13])[c:14]1[cH:15][cH:16][c:17]([CH3:20])[cH:18][cH:19]1)[cH:9][cH:10]2.[NH2:22][c:23]1[c:24]([C:25](=[O:26])[OH:27])[c:28]([F:32])[cH:29][cH:30][cH:31]1>>[Cl:1][c:2]1[n:3][c:4]([NH:22][c:23]2[c:24]([C:25](=[O:26])[OH:27])[c:28]([F:32])[cH:29][cH:30][cH:31]2)[c:5]2[c:6]([n:7]1)[n:8]([S:11](=[O:12])(=[O:13])[c:14]1[cH:15][cH:16][c:17]([CH3:20])[cH:18][cH:19]1)[cH:9][cH:10]2Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-ba29a186a96e477fabacebc5a165dc08
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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