Water → 1-(benzenesulfinylmethyl)-N-[(4-chlorophenyl)methyl]-6-(morpholinomethyl)-4-oxo-quinoline-3-carboxamide
Reaction equation
[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[cH:11][n:12]([CH2:28][S:29][c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[c:13]3[cH:14][cH:15][c:16]([CH2:21][N:22]4[CH2:23][CH2:24][O:25][CH2:26][CH2:27]4)[cH:17][c:18]3[c:19]2=[O:20])[cH:36][cH:37]1.[Cl:50][c:51]1[cH:52][c:53]([C:57]([O:58][OH:59])=[O:60])[cH:54][cH:55][cH:56]1.[Cl:61][CH2:62][Cl:63].[OH2:38].[c:39]1([CH3:40])[cH:41][cH:42][c:43]([S:44]([OH:45])(=[O:46])=[O:47])[cH:48][cH:49]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[cH:11][n:12]([CH2:28][S:29]([c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)=[O:46])[c:13]3[cH:14][cH:15][c:16]([CH2:21][N:22]4[CH2:23][CH2:24][O:25][CH2:26][CH2:27]4)[cH:17][c:18]3[c:19]2=[O:20])[cH:36][cH:37]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-5c9c21f6c6bc4223bc307c4b89fab5e4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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