Ethanol → 4-Isopropyl-N-[4-(1-propionyl-azetidin-3-yl)-phenyl]-benzenesulfonamide
Reaction equation
[CH3:44][CH2:45][OH:46].[CH:31]([CH3:32])([CH3:33])[c:34]1[cH:35][cH:36][c:37]([S:40](=[O:41])(=[O:42])[Cl:43])[cH:38][cH:39]1.[Cl:47][CH2:48][Cl:49].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]2[CH2:11][N:12]([C:14]([CH2:15][CH3:16])=[O:17])[CH2:13]2)[cH:8][cH:9]1.[NH2:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1.[cH:25]1[cH:26][cH:27][n:28][cH:29][cH:30]1>>[NH:1]([c:4]1[cH:5][cH:6][c:7]([CH:10]2[CH2:11][N:12]([C:14]([CH2:15][CH3:16])=[O:17])[CH2:13]2)[cH:8][cH:9]1)[S:40]([c:37]1[cH:36][cH:35][c:34]([CH:31]([CH3:32])[CH3:33])[cH:39][cH:38]1)(=[O:41])=[O:42]Participants
7
Sources & evidence
- ORD record
- ord-107bc49ad1da4ed4a832bd1c695de929
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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