1-Butanol → 5-chloro-4-N-[1-(8-chloro-2-pyridin-2-ylquinolin-3-yl)ethyl]pyrimidine-2,4-diamine
Reaction equation
[CH2:39]([OH:40])[CH2:41][CH2:42][CH3:43].[CH:21]([N:22]([CH2:23][CH3:24])[CH:25]([CH3:26])[CH3:27])([CH3:28])[CH3:29].[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[cH:7][c:8]([CH:18]([CH3:19])[NH2:20])[c:9](-[c:12]3[n:13][cH:14][cH:15][cH:16][cH:17]3)[n:10][c:11]12.[Cl:30][c:31]1[n:32][c:33]([NH2:38])[n:34][cH:35][c:36]1[Cl:37]>>[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[cH:7][c:8]([CH:18]([CH3:19])[NH:20][c:31]3[n:32][c:33]([NH2:38])[n:34][cH:35][c:36]3[Cl:37])[c:9](-[c:12]3[n:13][cH:14][cH:15][cH:16][cH:17]3)[n:10][c:11]12Participants
5
Sources & evidence
- ORD record
- ord-1d325a25df2049a28f9878f4e6e8b7de
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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