Ethanol → 3-{5-Cyano-6-[(2,2-dimethyl-propyl)-methyl-amino]-2-methanesulfinyl-pyrimidin-4-ylamino}-N-methoxy-4-methyl-benzamide
Reaction equation
[C:1](#[N:2])[c:3]1[c:4]([NH:18][c:19]2[cH:20][c:21]([C:22](=[O:23])[NH:24][O:25][CH3:26])[cH:27][cH:28][c:29]2[CH3:30])[n:5][c:6]([S:16][CH3:17])[n:7][c:8]1[N:9]([CH3:10])[CH2:11][C:12]([CH3:13])([CH3:14])[CH3:15].[CH3:37][CH2:38][OH:39].[I+3:31]([O-:32])([O-:33])([O-:34])[O-:35].[Na+:36].[OH2:40]>>[C:1](#[N:2])[c:3]1[c:4]([NH:18][c:19]2[cH:20][c:21]([C:22](=[O:23])[NH:24][O:25][CH3:26])[cH:27][cH:28][c:29]2[CH3:30])[n:5][c:6]([S:16]([CH3:17])=[O:32])[n:7][c:8]1[N:9]([CH3:10])[CH2:11][C:12]([CH3:13])([CH3:14])[CH3:15]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-c3893c9ab620483cabc01f0722f8058a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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