1,2-Dichloroethane → 2-(4-{1-Benzyl-4-[(3-bromo-benzyl)-methyl-amino]-pyrrolidine-2-carbonyl}-piperazin-1-yl)-benzonitrile
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH:9]([C:23](=[O:24])[OH:25])[CH2:10][CH:11]([N:13]([CH3:14])[CH2:15][c:16]2[cH:17][c:18]([Br:22])[cH:19][cH:20][cH:21]2)[CH2:12]1.[CH2:26]([Cl:27])[CH2:28][Cl:29].[N:40]1([c:46]2[c:47]([C:48]#[N:49])[cH:50][cH:51][cH:52][cH:53]2)[CH2:41][CH2:42][NH:43][CH2:44][CH2:45]1.[O:54]=[CH:55][N:56]([CH3:57])[CH3:58].[OH:30][n:31]1[c:32]2[c:33]([cH:34][cH:35][cH:36][cH:37]2)[n:38][n:39]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH:9]([C:23](=[O:25])[N:43]2[CH2:42][CH2:41][N:40]([c:46]3[c:47]([C:48]#[N:49])[cH:50][cH:51][cH:52][cH:53]3)[CH2:45][CH2:44]2)[CH2:10][CH:11]([N:13]([CH3:14])[CH2:15][c:16]2[cH:17][c:18]([Br:22])[cH:19][cH:20][cH:21]2)[CH2:12]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-20f7f2130b24471ba7d65deba78834fe
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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