1,2-Dichloroethane → trans-2-Methyl-1-{4-[3-(4-pyrrolidin-1-ylmethyl-phenyl)-cyclobutylmethyl]-piperazin-1-yl}-propan-1-one
Reaction equation
[C:33]([CH:34]([CH3:35])[CH3:36])(=[O:37])[Cl:38].[CH:24]([N:25]([CH:26]([CH3:27])[CH3:28])[CH2:29][CH3:30])([CH3:31])[CH3:32].[Cl:39][CH2:40][CH2:41][Cl:42].[N:1]1([CH2:6][c:7]2[cH:8][cH:9][c:10]([CH:13]3[CH2:14][CH:15]([CH2:17][N:18]4[CH2:19][CH2:20][NH:21][CH2:22][CH2:23]4)[CH2:16]3)[cH:11][cH:12]2)[CH2:2][CH2:3][CH2:4][CH2:5]1>>[N:1]1([CH2:6][c:7]2[cH:8][cH:9][c:10]([CH:13]3[CH2:14][CH:15]([CH2:17][N:18]4[CH2:19][CH2:20][N:21]([C:33]([CH:34]([CH3:35])[CH3:36])=[O:37])[CH2:22][CH2:23]4)[CH2:16]3)[cH:11][cH:12]2)[CH2:2][CH2:3][CH2:4][CH2:5]1Participants
5
Sources & evidence
- ORD record
- ord-78363cafd2254774af947bf12466a845
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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