Dimethyl Sulfoxide → 4-((4-bromo-1-trityl-1H-imidazol-2-yl)(5-ethoxy-2-fluoro-3-isopropoxyphenyl)methylamino)-N'-hydroxybenzamidine
Reaction equation
[Br:1][c:2]1[n:3][c:4]([N:26]([c:27]2[cH:28][cH:29][c:30]([C:31]#[N:32])[cH:33][cH:34]2)[CH2:35][c:36]2[c:37]([F:49])[c:38]([O:45][CH:46]([CH3:47])[CH3:48])[cH:39][c:40]([O:42][CH2:43][CH3:44])[cH:41]2)[n:5]([C:7]([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:6]1.[CH3:53][S:54]([CH3:55])=[O:56].[NH2:51][OH:52].[OH2:50]>>[Br:1][c:2]1[n:3][c:4]([N:26]([c:27]2[cH:28][cH:29][c:30]([C:31](=[N:32][OH:50])[NH2:51])[cH:33][cH:34]2)[CH2:35][c:36]2[c:37]([F:49])[c:38]([O:45][CH:46]([CH3:47])[CH3:48])[cH:39][c:40]([O:42][CH2:43][CH3:44])[cH:41]2)[n:5]([C:7]([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:6]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-c62ca471a1fe41fd91e1ecc226d070d2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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