Ethanol → 3-[2-(2,5-Dichloro-pyrimidin-4-ylamino)-5-morpholin-4-yl-phenoxy]-propionitrile
Reaction equation
[CH3:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29].[CH3:39][CH2:40][OH:41].[Cl:30][c:31]1[n:32][cH:33][c:34]([Cl:38])[c:35]([Cl:37])[n:36]1.[H:21][H:22].[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][cH:9][c:10]([N+:18]([O-:19])=[O:20])[c:11]([O:12][CH2:13][CH2:14][C:15]#[N:16])[cH:17]2)[CH2:5][CH2:6]1.[OH2:42]>>[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][cH:9][c:10]([NH:18][c:35]3[c:34]([Cl:38])[cH:33][n:32][c:31]([Cl:30])[n:36]3)[c:11]([O:12][CH2:13][CH2:14][C:15]#[N:16])[cH:17]2)[CH2:5][CH2:6]1Participants
7
Sources & evidence
- ORD record
- ord-d96d13d3fb974541b916b52866599057
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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