Water → 3-Amino-6-(1-isopropyl-6-oxo-1,6-dihydro-3-pyridazinyl)-5-phenyl-2-pyrazinecarbonitrile
Reaction equation
[CH:1]([CH3:2])([CH3:3])[n:4]1[n:5][c:6](-[c:11]2[c:12](-[c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[n:13][c:14]([NH:19][CH2:20][c:21]3[cH:22][cH:23][c:24]([O:25][CH3:26])[cH:27][cH:28]3)[c:15]([C:17]#[N:18])[n:16]2)[cH:7][cH:8][c:9]1=[O:10].[Cl:35][C:36]1=[C:47]([Cl:48])[C:45](=[O:46])[C:42]([C:43]#[N:44])=[C:39]([C:40]#[N:41])[C:37]1=[O:38].[Cl:50][CH:51]([Cl:52])[Cl:53].[OH2:49]>>[CH:1]([CH3:2])([CH3:3])[n:4]1[n:5][c:6](-[c:11]2[c:12](-[c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[n:13][c:14]([NH2:19])[c:15]([C:17]#[N:18])[n:16]2)[cH:7][cH:8][c:9]1=[O:10]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-e03605546ff74a1889581b70a5a9a1d7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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