Hydrochloric Acid → 3-[2-(trifluoromethyl)-4'-(methylthio)benzhydryloxy]-N-(1-adamantyl)azetidine-1-carboxamide
Reaction equation
[C:26]12([N:36]=[C:37]=[O:38])[CH2:27][CH:28]3[CH2:29][CH:30]([CH2:31][CH:32]([CH2:33]1)[CH2:34]3)[CH2:35]2.[Cl:39][CH2:40][Cl:41].[ClH:1].[F:2][C:3]([c:4]1[c:5]([CH:6]([c:7]2[cH:8][cH:9][c:10]([S:13][CH3:14])[cH:11][cH:12]2)[O:15][CH:16]2[CH2:17][NH:18][CH2:19]2)[cH:20][cH:21][cH:22][cH:23]1)([F:24])[F:25]>>[F:2][C:3]([c:4]1[c:5]([CH:6]([c:7]2[cH:8][cH:9][c:10]([S:13][CH3:14])[cH:11][cH:12]2)[O:15][CH:16]2[CH2:17][N:18]([C:37]([NH:36][C:26]34[CH2:27][CH:28]5[CH2:29][CH:30]([CH2:31][CH:32]([CH2:33]3)[CH2:34]5)[CH2:35]4)=[O:38])[CH2:19]2)[cH:20][cH:21][cH:22][cH:23]1)([F:24])[F:25]Participants
5
Sources & evidence
- ORD record
- ord-1644f0b86442485a9804e5948a732cd4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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