Methylamine → 4-(1-{2-[2-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-1,2,3,4-tetrahydroisoquinolin-7-yl}piperidin-4-yl)-N-methylbenzamide
Reaction equation
[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:40][NH2:41].[NH2:1][c:2]1[n:3][c:4]([N:33]2[CH2:34][CH2:35][N:36]([CH3:39])[CH2:37][CH2:38]2)[cH:5][c:6]([N:8]2[CH2:9][c:10]3[cH:11][c:12]([N:18]4[CH2:19][CH2:20][CH:21]([c:24]5[cH:25][cH:26][c:27]([C:28](=[O:29])[OH:30])[cH:31][cH:32]5)[CH2:22][CH2:23]4)[cH:13][cH:14][c:15]3[CH2:16][CH2:17]2)[n:7]1>>[NH2:1][c:2]1[n:3][c:4]([N:33]2[CH2:34][CH2:35][N:36]([CH3:39])[CH2:37][CH2:38]2)[cH:5][c:6]([N:8]2[CH2:9][c:10]3[cH:11][c:12]([N:18]4[CH2:19][CH2:20][CH:21]([c:24]5[cH:25][cH:26][c:27]([C:28](=[O:30])[NH:41][CH3:40])[cH:31][cH:32]5)[CH2:22][CH2:23]4)[cH:13][cH:14][c:15]3[CH2:16][CH2:17]2)[n:7]1Participants
4
Sources & evidence
- ORD record
- ord-2f1039c8cc3c43cbbcb836eba2d6bdfe
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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