Acetonitrile → 3-[2-[2-(2-Methylpyrrolidin-1-yl)ethyl]-1-benzofuran-5-yl]benzonitrile
Reaction equation
[C:31](=[O:32])([O-:33])[O-:34].[CH3:1][S:2]([O:3][CH2:6][CH2:7][c:8]1[o:9][c:10]2[c:11]([cH:12]1)[cH:13][c:14](-[c:17]1[cH:18][c:19]([C:23]#[N:24])[cH:20][cH:21][cH:22]1)[cH:15][cH:16]2)(=[O:4])=[O:5].[CH3:25][CH:26]1[NH:27][CH2:28][CH2:29][CH2:30]1.[CH3:37][C:38]#[N:39].[Cl:40][CH2:41][Cl:42].[Cs+:35].[Cs+:36]>>[CH2:6]([CH2:7][c:8]1[o:9][c:10]2[c:11]([cH:12]1)[cH:13][c:14](-[c:17]1[cH:18][c:19]([C:23]#[N:24])[cH:20][cH:21][cH:22]1)[cH:15][cH:16]2)[N:27]1[CH:26]([CH3:25])[CH2:30][CH2:29][CH2:28]1Participants
7
Sources & evidence
- ORD record
- ord-f17138a3327c4bda9fe15d0790f3844c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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