Hydrochloric Acid → N-[4-[2-(3-ethyl-4H-triazol-4-yl)ethoxy]phenyl]-4-(5-phenyl-4-isoxazolyl)butaneamide
Reaction equation
[CH2:1]([CH3:2])[N:3]1[NH:4][N:5]=[CH:6][CH:7]1[CH2:8][CH2:9][O:10][c:11]1[cH:12][cH:13][c:14]([NH2:15])[cH:16][cH:17]1.[CH2:47]([N:48]=[C:49]=[N:50][CH2:51][CH2:52][CH2:53][N:54]([CH3:55])[CH3:56])[CH3:57].[CH3:59][N:60]([CH3:61])[CH:62]=[O:63].[ClH:46].[OH2:35].[OH2:58].[OH:36][n:37]1[c:38]2[cH:39][cH:40][cH:41][cH:42][c:43]2[n:44][n:45]1.[c:18]1(-[c:24]2[c:25]([CH2:29][CH2:30][CH2:31][C:32](=[O:33])[OH:34])[cH:26][n:27][o:28]2)[cH:19][cH:20][cH:21][cH:22][cH:23]1>>[CH2:1]([CH3:2])[N:3]1[NH:4][N:5]=[CH:6][CH:7]1[CH2:8][CH2:9][O:10][c:11]1[cH:12][cH:13][c:14]([NH:15][C:32]([CH2:31][CH2:30][CH2:29][c:25]2[c:24](-[c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[o:28][n:27][cH:26]2)=[O:33])[cH:16][cH:17]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-5fd736dbfa1944dda28e76c60d0fe2f8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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