Dichloromethane → 3-(1,3-Benzoxazol-2-yl)-5-[1-(1-methyl-1-oxido-piperidin-1-ium-4-yl)pyrazol-4-yl]pyridin-2-amine
Reaction equation
[Cl:40][CH2:41][Cl:42].[OH:1][O:2][C:3]([c:4]1[cH:5][c:6]([Cl:7])[cH:8][cH:9][cH:10]1)=[O:11].[o:12]1[c:13](-[c:21]2[c:22]([NH2:39])[n:23][cH:24][c:25](-[c:27]3[cH:28][n:29][n:30]([CH:32]4[CH2:33][CH2:34][N:35]([CH3:38])[CH2:36][CH2:37]4)[cH:31]3)[cH:26]2)[n:14][c:15]2[c:16]1[cH:17][cH:18][cH:19][cH:20]2>>[O-:1][N+:35]1([CH3:38])[CH2:34][CH2:33][CH:32]([n:30]2[n:29][cH:28][c:27](-[c:25]3[cH:24][n:23][c:22]([NH2:39])[c:21](-[c:13]4[o:12][c:16]5[c:15]([n:14]4)[cH:20][cH:19][cH:18][cH:17]5)[cH:26]3)[cH:31]2)[CH2:37][CH2:36]1Participants
4
Sources & evidence
- ORD record
- ord-f7b3eb5e718e4ab0b46f972c0ad8d376
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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