Hydrochloric Acid → Methyl 4-methylsulfanyl-2-[(4-nitro-2-phenylbenzoyl)amino]butanoate
Reaction equation
[CH3:32][N:33]([CH3:34])[CH2:35][CH2:36][CH2:37][N:38]=[C:39]=[N:40][CH2:41][CH3:42].[CH3:44][O:45][C:46]([CH:47]([NH2:48])[CH2:49][CH2:50][S:51][CH3:52])=[O:53].[CH3:59][CH2:60][N:61]([CH2:62][CH3:63])[CH2:64][CH3:65].[ClH:31].[ClH:43].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6](-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[c:7]([C:8](=[O:9])[OH:10])[cH:11][cH:12]1.[O:54]=[CH:55][N:56]([CH3:57])[CH3:58].[OH:19][n:20]1[c:21](=[O:22])[c:23]2[cH:24][cH:25][cH:26][cH:27][c:28]2[n:29][n:30]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6](-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[c:7]([C:8](=[O:10])[NH:48][CH:47]([C:46]([O:45][CH3:44])=[O:53])[CH2:49][CH2:50][S:51][CH3:52])[cH:11][cH:12]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-99b9c22b6e77418dbcc65318344e92a0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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