1-Butanol → 2-(4-(difluoromethoxy)-N-(1-(4-(pyrimidin-5-yl)phenyl)cyclobutyl)phenylsulfonamido) acetic acid
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([N:12]([S:13](=[O:14])(=[O:15])[c:16]3[cH:17][cH:18][c:19]([O:22][CH:23]([F:24])[F:25])[cH:20][cH:21]3)[CH2:26][C:27](=[O:28])[OH:29])[CH2:9][CH2:10][CH2:11]2)[cH:6][cH:7]1.[CH2:81]([OH:82])[CH2:83][CH2:84][CH3:85].[CH:47]1([P:48]([CH:49]2[CH2:50][CH2:51][CH2:52][CH2:53][CH2:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][c:60]2-[c:61]2[c:62]([CH:63]([CH3:64])[CH3:65])[cH:66][c:67]([CH:68]([CH3:69])[CH3:70])[cH:71][c:72]2[CH:73]([CH3:74])[CH3:75])[CH2:76][CH2:77][CH2:78][CH2:79][CH2:80]1.[K+:44].[K+:45].[K+:46].[P:39]([O-:40])([O-:41])([O-:42])=[O:43].[n:30]1[cH:31][n:32][cH:33][c:34]([B:36]([OH:37])[OH:38])[cH:35]1>>[c:2]1(-[c:34]2[cH:33][n:32][cH:31][n:30][cH:35]2)[cH:3][cH:4][c:5]([C:8]2([N:12]([S:13](=[O:14])(=[O:15])[c:16]3[cH:17][cH:18][c:19]([O:22][CH:23]([F:24])[F:25])[cH:20][cH:21]3)[CH2:26][C:27](=[O:28])[OH:29])[CH2:9][CH2:10][CH2:11]2)[cH:6][cH:7]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-f8b750085fb743f78dd029441a7bf7f3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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