1-Butanol → 3-[1-[(2-Chloro-5-iodopyrimidin-4-yl)amino]ethyl]-8-(1-methylpyrazol-4-yl)-2-phenylisoquinolin-1-one
Reaction equation
[CH2:45]([OH:46])[CH2:47][CH2:48][CH3:49].[CH:36]([N:37]([CH2:38][CH3:39])[CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[Cl:27][c:28]1[n:29][cH:30][c:31]([I:35])[c:32]([Cl:34])[n:33]1.[NH2:1][CH:2]([CH3:3])[c:4]1[n:5](-[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:6](=[O:20])[c:7]2[c:8](-[c:14]3[cH:15][n:16][n:17]([CH3:19])[cH:18]3)[cH:9][cH:10][cH:11][c:12]2[cH:13]1>>[NH:1]([CH:2]([CH3:3])[c:4]1[n:5](-[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:6](=[O:20])[c:7]2[c:8](-[c:14]3[cH:15][n:16][n:17]([CH3:19])[cH:18]3)[cH:9][cH:10][cH:11][c:12]2[cH:13]1)[c:32]1[c:31]([I:35])[cH:30][n:29][c:28]([Cl:27])[n:33]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-828e3f8394a3450bb48bdc171b657027
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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