Chloride → 2-[5-(2-Bromoacetyl)-2-ethoxyphenyl]-5-methyl-7-cycloheptyl-3H-imidazo[5,1-f][1,2,4]triazin-4-one
Reaction equation
[Al+3:36].[Br:28][CH2:29][C:30](=[O:31])[Br:32].[CH2:1]([CH3:2])[O:3][c:4]1[c:5](-[c:10]2[n:11][n:12]3[c:13]([c:14](=[O:16])[nH:15]2)[c:17]([CH3:27])[n:18][c:19]3[CH:20]2[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26]2)[cH:6][cH:7][cH:8][cH:9]1.[Cl-:33].[Cl-:34].[Cl-:35]>>[CH2:1]([CH3:2])[O:3][c:4]1[c:5](-[c:10]2[n:11][n:12]3[c:13]([c:14](=[O:16])[nH:15]2)[c:17]([CH3:27])[n:18][c:19]3[CH:20]2[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26]2)[cH:6][c:7]([C:30]([CH2:29][Br:28])=[O:31])[cH:8][cH:9]1Participants
5
Sources & evidence
- ORD record
- ord-ff788f9dbeeb4211995631e7b6cc5bba
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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