Potassium Cation → 1-(Cyclopropylmethyl)-3-(4-(4-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2-Propylbenzyl)piperazine-1-carbonyl)phenyl)urea
Reaction equation
[C:56](=[O:57])([O-:58])[O-:59].[CH3:22][CH2:23][N:24]([CH2:25][CH3:26])[CH2:27][CH3:28].[CH3:29][S:30](=[O:31])(=[O:32])[Cl:33].[CH:34]1([CH2:37][NH:38][C:39](=[O:40])[NH:41][c:42]2[cH:43][cH:44][c:45]([C:48](=[O:49])[N:50]3[CH2:51][CH2:52][NH:53][CH2:54][CH2:55]3)[cH:46][cH:47]2)[CH2:35][CH2:36]1.[Cl:62][CH2:63][Cl:64].[F:1][C:2]([C:3]([C:4]([F:5])([F:6])[F:7])([OH:8])[c:9]1[cH:10][c:11]([CH2:17][CH2:18][CH3:19])[c:12]([CH2:15][OH:16])[cH:13][cH:14]1)([F:20])[F:21].[K+:60].[K+:61]>>[F:1][C:2]([C:3]([C:4]([F:5])([F:6])[F:7])([OH:8])[c:9]1[cH:10][c:11]([CH2:17][CH2:18][CH3:19])[c:12]([CH2:15][N:53]2[CH2:52][CH2:51][N:50]([C:48]([c:45]3[cH:44][cH:43][c:42]([NH:41][C:39]([NH:38][CH2:37][CH:34]4[CH2:35][CH2:36]4)=[O:40])[cH:47][cH:46]3)=[O:49])[CH2:55][CH2:54]2)[cH:13][cH:14]1)([F:20])[F:21]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-965a54e61a1840259d91ad4fdd2017eb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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