Sodium ion → [3-(Oxan-4-ylamino)-1-propan-2-ylcyclopentyl]-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone
Reaction equation
[C:56]([O:57][BH-:58]([O:59][C:60](=[O:61])[CH3:62])[O:63][C:64](=[O:65])[CH3:66])(=[O:67])[CH3:68].[CH2:70]([Cl:71])[Cl:72].[CH3:49][CH2:50][N:51]([CH2:52][CH3:53])[CH2:54][CH3:55].[CH3:73][CH2:74][O:75][C:76]([CH3:77])=[O:78].[CH:15]([CH3:16])([CH3:17])[C:18]1([C:24](=[O:25])[N:26]2[CH2:27][CH2:28][N:29]([c:32]3[cH:33][c:34]([C:38]([F:39])([F:40])[F:41])[cH:35][cH:36][cH:37]3)[CH2:30][CH2:31]2)[CH2:19][CH:20]([NH2:23])[CH2:21][CH2:22]1.[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[F:8][C:9]([F:10])([F:11])[C:12]([OH:13])=[O:14].[Na+:69].[O:42]1[CH2:43][CH2:44][C:45](=[O:48])[CH2:46][CH2:47]1>>[CH:15]([CH3:16])([CH3:17])[C:18]1([C:24](=[O:25])[N:26]2[CH2:27][CH2:28][N:29]([c:32]3[cH:33][c:34]([C:38]([F:39])([F:40])[F:41])[cH:35][cH:36][cH:37]3)[CH2:30][CH2:31]2)[CH2:19][CH:20]([NH:23][CH:45]2[CH2:44][CH2:43][O:42][CH2:47][CH2:46]2)[CH2:21][CH2:22]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-bd98fb1a832746aaa6d30c1a022eb1d2
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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