Acetonitrile → Methyl 3-(4-{[4-[5-fluoro-2-(methyloxy)phenyl]-2-hydroxy-4-methyl-2-(trifluoromethyl)pentyl]amino}-6-methyl-1H-indazol-1-yl)benzoate
Reaction equation
[CH3:21][C:22]#[N:23].[CH3:45][CH2:46][O:47][C:48](=[O:49])[CH3:50].[F:1][c:2]1[cH:3][cH:4][c:5]([O:19][CH3:20])[c:6]([C:8]([CH2:9][C:10]2([C:13]([F:14])([F:15])[F:16])[O:11][CH2:12]2)([CH3:17])[CH3:18])[cH:7]1.[F:51][C:52]([F:53])([F:54])[S:55]([O-:56])(=[O:57])=[O:58].[F:60][C:61]([F:62])([F:63])[S:64]([O-:65])(=[O:66])=[O:67].[F:68][C:69]([F:70])([F:71])[S:72]([O-:73])(=[O:74])=[O:75].[NH2:24][c:25]1[c:26]2[cH:27][n:28][n:29](-[c:35]3[cH:36][c:37]([C:38](=[O:39])[O:40][CH3:41])[cH:42][cH:43][cH:44]3)[c:30]2[cH:31][c:32]([CH3:34])[cH:33]1.[Y+3:59]>>[F:1][c:2]1[cH:3][cH:4][c:5]([O:19][CH3:20])[c:6]([C:8]([CH2:9][C:10]([OH:11])([CH2:12][NH:24][c:25]2[c:26]3[cH:27][n:28][n:29](-[c:35]4[cH:36][c:37]([C:38](=[O:39])[O:40][CH3:41])[cH:42][cH:43][cH:44]4)[c:30]3[cH:31][c:32]([CH3:34])[cH:33]2)[C:13]([F:14])([F:15])[F:16])([CH3:17])[CH3:18])[cH:7]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-d22d7d9868db4c01be4c9026549888b9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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