Acetonitrile → t-Butyl 4-(3-(1-(3,5-dichlorophenyl)ethylamino)-4-(2,2,2-trifluoroacetyl)phenyl)piperazine-1-carboxylate
Reaction equation
[CH3:47][C:48]#[N:49].[CH:38]([N:39]([CH2:40][CH3:41])[CH:42]([CH3:43])[CH3:44])([CH3:45])[CH3:46].[Cl:1][c:2]1[cH:3][c:4]([CH:9]([CH3:10])[NH:11][c:12]2[c:13]([C:19]([C:20]([F:21])([F:22])[F:23])=[O:24])[cH:14][cH:15][c:16]([F:18])[cH:17]2)[cH:5][c:6]([Cl:8])[cH:7]1.[N:25]1([C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]1>>[Cl:1][c:2]1[cH:3][c:4]([CH:9]([CH3:10])[NH:11][c:12]2[c:13]([C:19]([C:20]([F:21])([F:22])[F:23])=[O:24])[cH:14][cH:15][c:16]([N:28]3[CH2:27][CH2:26][N:25]([C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:30][CH2:29]3)[cH:17]2)[cH:5][c:6]([Cl:8])[cH:7]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-538b8dbfcb6b403bbb1e49fd7499f76a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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