Water → 2'-Chloro-5'-[4-(4-methanesulfonyl-piperazin-1-ylmethyl)-phenylcarbamoyl]-biphenyl-4-carboxylic acid ethyl ester
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][cH:8][c:9](-[c:12]2[cH:13][c:14]([C:19](=[O:20])[OH:21])[cH:15][cH:16][c:17]2[Cl:18])[cH:10][cH:11]1.[CH3:22][S:23](=[O:24])(=[O:25])[N:26]1[CH2:27][CH2:28][N:29]([CH2:32][c:33]2[cH:34][cH:35][c:36]([NH2:39])[cH:37][cH:38]2)[CH2:30][CH2:31]1.[CH3:40][CH2:41][N:42]=[C:43]=[N:44][CH2:45][CH2:46][CH2:47][N:48]([CH3:49])[CH3:50].[CH3:61][N:62]1[CH2:63][CH2:64][O:65][CH2:66][CH2:67]1.[O:68]=[CH:69][N:70]([CH3:71])[CH3:72].[OH2:73].[OH:51][n:52]1[c:53]2[c:54]([cH:55][cH:56][cH:57][cH:58]2)[n:59][n:60]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][cH:8][c:9](-[c:12]2[cH:13][c:14]([C:19](=[O:21])[NH:39][c:36]3[cH:35][cH:34][c:33]([CH2:32][N:29]4[CH2:28][CH2:27][N:26]([S:23]([CH3:22])(=[O:24])=[O:25])[CH2:31][CH2:30]4)[cH:38][cH:37]3)[cH:15][cH:16][c:17]2[Cl:18])[cH:10][cH:11]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-a0bf8e94a95141a9bd5d69df91600b7f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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