Hydrochloric Acid → [3-[(3-Ethoxyoxan-4-yl)amino]-1-propan-2-ylcyclopentyl]-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone
Reaction equation
[C:47]([O:48][BH-:49]([O:50][C:51](=[O:52])[CH3:53])[O:54][C:55](=[O:56])[CH3:57])(=[O:58])[CH3:59].[CH2:30]([CH3:31])[O:32][CH:33]1[CH2:34][O:35][CH2:36][CH2:37][C:38]1=[O:39].[CH2:61]([Cl:62])[Cl:63].[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:64][CH2:65][O:66][C:67]([CH3:68])=[O:69].[CH:3]([CH3:4])([CH3:5])[C:6]1([C:12](=[O:13])[N:14]2[CH2:15][CH2:16][N:17]([c:20]3[cH:21][c:22]([C:26]([F:27])([F:28])[F:29])[cH:23][cH:24][cH:25]3)[CH2:18][CH2:19]2)[CH2:7][CH:8]([NH2:11])[CH2:9][CH2:10]1.[ClH:1].[ClH:2].[Na+:60]>>[CH:3]([CH3:4])([CH3:5])[C:6]1([C:12](=[O:13])[N:14]2[CH2:15][CH2:16][N:17]([c:20]3[cH:21][c:22]([C:26]([F:27])([F:28])[F:29])[cH:23][cH:24][cH:25]3)[CH2:18][CH2:19]2)[CH2:7][CH:8]([NH:11][CH:38]2[CH:33]([O:32][CH2:30][CH3:31])[CH2:34][O:35][CH2:36][CH2:37]2)[CH2:9][CH2:10]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-829dfec8a74449e9aacda48f274f59b1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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