Hydrochloric Acid → [[4-[4-[2-[(4-Tert-butylphenyl)methoxy]phenyl]-2-[2-(4-cyanophenyl)ethyl]but-3-enyl]benzoyl]amino]urea
Reaction equation
[C:7]([CH3:8])([CH3:9])([CH3:10])[c:11]1[cH:12][cH:13][c:14]([CH2:15][O:16][c:17]2[c:18]([CH:23]=[CH:24][CH:25]([CH2:26][c:27]3[cH:28][cH:29][c:30]([C:31](=[O:32])[OH:33])[cH:34][cH:35]3)[CH2:36][CH2:37][c:38]3[cH:39][cH:40][c:41]([C:44]#[N:45])[cH:42][cH:43]3)[cH:19][cH:20][cH:21][cH:22]2)[cH:46][cH:47]1.[CH2:63]1[O:64][CH2:65][CH2:66][CH2:67]1.[CH3:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[Cl:1][C:2]([C:3]([Cl:4])=[O:5])=[O:6].[ClH:48].[NH2:49][NH:50][C:51](=[O:52])[NH2:53].[Na+:55].[O:69]=[CH:70][N:71]([CH3:72])[CH3:73].[OH-:54].[OH2:68]>>[C:7]([CH3:8])([CH3:9])([CH3:10])[c:11]1[cH:12][cH:13][c:14]([CH2:15][O:16][c:17]2[c:18]([CH:23]=[CH:24][CH:25]([CH2:26][c:27]3[cH:28][cH:29][c:30]([C:31](=[O:32])[NH:49][NH:50][C:51](=[O:52])[NH2:53])[cH:34][cH:35]3)[CH2:36][CH2:37][c:38]3[cH:39][cH:40][c:41]([C:44]#[N:45])[cH:42][cH:43]3)[cH:19][cH:20][cH:21][cH:22]2)[cH:46][cH:47]1Participants
11
Reactant 10
Product 1
Sources & evidence
- ORD record
- ord-af757611d7eb4ac8b35b74bd915cee54
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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