Dichloromethane → 3-{6-[4-(4-Benzyl-phthalazin-1-yl)-piperazin-1-yl]-pyridin-3-yl}-1,1-dimethyl-urea
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[n:9][n:10][c:11]([N:18]2[CH2:19][CH2:20][N:21]([c:24]3[cH:25][cH:26][c:27]([NH2:30])[cH:28][n:29]3)[CH2:22][CH2:23]2)[c:12]2[cH:13][cH:14][cH:15][cH:16][c:17]12.[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[CH3:38][N:39]([C:40](=[O:41])[Cl:42])[CH3:43].[Cl:44][CH2:45][Cl:46]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[n:9][n:10][c:11]([N:18]2[CH2:19][CH2:20][N:21]([c:24]3[cH:25][cH:26][c:27]([NH:30][C:40]([N:39]([CH3:38])[CH3:43])=[O:41])[cH:28][n:29]3)[CH2:22][CH2:23]2)[c:12]2[cH:13][cH:14][cH:15][cH:16][c:17]12Participants
5
Sources & evidence
- ORD record
- ord-207be532069643339ee9dee231d7177a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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