Acetonitrile → 1-(3,4,5-trimethoxybenzoyl)-3-(2-(4-(1H-benzimidazol-2-yl-amino)piperidin-1-yl)ethyl)-3-phenylpyrrolidine
Reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][C:10]([CH2:13][CH2:14][O:15][S:16]([CH3:17])(=[O:18])=[O:19])([c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:11][CH2:12]2)[cH:26][c:27]([O:31][CH3:32])[c:28]1[O:29][CH3:30].[CH3:59][C:60]#[N:61].[CH3:62][CH2:63][O:64][C:65](=[O:66])[CH3:67].[CH:50]([N:51]([CH2:52][CH3:53])[CH:54]([CH3:55])[CH3:56])([CH3:57])[CH3:58].[Cl:68][CH2:69][Cl:70].[IH:33].[nH:34]1[c:35]([NH:43][CH:44]2[CH2:45][CH2:46][NH:47][CH2:48][CH2:49]2)[n:36][c:37]2[c:38]1[cH:39][cH:40][cH:41][cH:42]2>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][C:10]([CH2:13][CH2:14][N:47]3[CH2:46][CH2:45][CH:44]([NH:43][c:35]4[nH:34][c:38]5[c:37]([n:36]4)[cH:42][cH:41][cH:40][cH:39]5)[CH2:49][CH2:48]3)([c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:11][CH2:12]2)[cH:26][c:27]([O:31][CH3:32])[c:28]1[O:29][CH3:30]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-3793f1fb81b04379b079f8e051da8e93
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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