Potassium Cation → 4-(3-{Ethyl[3-(propylsulfanyl)propyl]amino}-2-hydroxypropoxy)benzonitrile
Reaction equation
[Br:17][CH2:18][CH2:19][CH2:20][S:21][CH2:22][CH2:23][CH3:24].[C:25](=[O:26])([O-:27])[O-:28].[CH2:1]([CH3:2])[NH:3][CH2:4][CH:5]([CH2:6][O:7][c:8]1[cH:9][cH:10][c:11]([C:12]#[N:13])[cH:14][cH:15]1)[OH:16].[CH:31]([OH:32])([CH3:33])[CH3:34].[K+:29].[K+:30]>>[CH2:1]([CH3:2])[N:3]([CH2:4][CH:5]([CH2:6][O:7][c:8]1[cH:9][cH:10][c:11]([C:12]#[N:13])[cH:14][cH:15]1)[OH:16])[CH2:18][CH2:19][CH2:20][S:21][CH2:22][CH2:23][CH3:24]Participants
6
Sources & evidence
- ORD record
- ord-c856e45270bb44ab9a2b6c0010c78b35
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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