Acetone → N-[4-diethylamino-1,1-dimethyl-2-butynyl]-4,4-diphenyl-2-cyclopentenylamine
Reaction equation
[CH2:19]([CH3:20])[N:21]([CH2:22][C:23]#[C:24][C:25]([CH3:26])([CH3:27])[NH2:28])[CH2:29][CH3:30].[CH3:33][C:34](=[O:35])[CH3:36].[I-:32].[Na+:31].[c:1]1([C:7]2([c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)[CH:8]=[CH:9][CH:10]([Cl:12])[CH2:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]2([c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)[CH:8]=[CH:9][CH:10]([NH:28][C:25]([C:24]#[C:23][CH2:22][N:21]([CH2:19][CH3:20])[CH2:29][CH3:30])([CH3:26])[CH3:27])[CH2:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
6
Sources & evidence
- ORD record
- ord-9cafd7898062460ca8129366923bc0f5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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