Water → 1-Benzyl-4-[4-(furan-2-carbonyl)-piperazin-1-yl]-6-methyl-2-oxo-1,2-dihydro-quinolin-3-carbonitrile
Reaction equation
[CH2:9]([c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)[n:16]1[c:17](=[O:35])[c:18]([C:33]#[N:34])[c:19]([N:27]2[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]2)[c:20]2[cH:21][c:22]([CH3:26])[cH:23][cH:24][c:25]12.[OH2:36].[cH:37]1[cH:38][cH:39][n:40][cH:41][cH:42]1.[o:1]1[c:2]([C:6](=[O:7])[Cl:8])[cH:3][cH:4][cH:5]1>>[o:1]1[c:2]([C:6](=[O:7])[N:30]2[CH2:29][CH2:28][N:27]([c:19]3[c:18]([C:33]#[N:34])[c:17](=[O:35])[n:16]([CH2:9][c:10]4[cH:11][cH:12][cH:13][cH:14][cH:15]4)[c:25]4[c:20]3[cH:21][c:22]([CH3:26])[cH:23][cH:24]4)[CH2:32][CH2:31]2)[cH:3][cH:4][cH:5]1Participants
5
Sources & evidence
- ORD record
- ord-8c9881551ab54d6b974155f659f0ee4c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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