Acetic Acid → 2-[4-[3-(3,4-Dichlorophenyl)prop-2-enoyl]-7-oxo-1,4-diazepan-1-yl]acetaldehyde
Reaction equation
[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:28][C:29](=[O:30])[CH3:31].[CH3:32][C:33](=[O:34])[OH:35].[Cl:1][c:2]1[cH:3][c:4]([CH:9]=[CH:10][C:11](=[O:12])[N:13]2[CH2:14][CH2:15][N:16]([CH2:21][C:22](=[O:23])[N:24]([O:25][CH3:26])[CH3:27])[C:17](=[O:20])[CH2:18][CH2:19]2)[cH:5][cH:6][c:7]1[Cl:8].[K+:41].[S:36](=[O:37])(=[O:38])([OH:39])[O-:40]>>[Cl:1][c:2]1[cH:3][c:4]([CH:9]=[CH:10][C:11](=[O:12])[N:13]2[CH2:14][CH2:15][N:16]([CH2:21][CH:22]=[O:23])[C:17](=[O:20])[CH2:18][CH2:19]2)[cH:5][cH:6][c:7]1[Cl:8]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-55fce1dc66654a8892c2a1583e4e4c14
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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