Acetic Acid → 1-[2-(3-Carbamoyl-4-hydroxyphenoxy)-ethylamino]-3-[4-(thiazol-2-yl)-phenoxy]-2-propanol
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([CH2:9][CH:10]([CH2:11][O:12][c:13]1[cH:14][cH:15][c:16](-[c:19]2[s:20][cH:21][cH:22][n:23]2)[cH:17][cH:18]1)[OH:24])[CH2:25][CH2:26][O:27][c:28]1[cH:29][c:30]([C:35]([NH2:36])=[O:37])[c:31]([OH:34])[cH:32][cH:33]1.[CH3:38][C:39](=[O:40])[OH:41].[OH:42][C:43]([C:44]([F:45])([F:46])[F:47])=[O:48]>>[NH:8]([CH2:9][CH:10]([CH2:11][O:12][c:13]1[cH:14][cH:15][c:16](-[c:19]2[s:20][cH:21][cH:22][n:23]2)[cH:17][cH:18]1)[OH:24])[CH2:25][CH2:26][O:27][c:28]1[cH:29][c:30]([C:35]([NH2:36])=[O:37])[c:31]([OH:34])[cH:32][cH:33]1Participants
4
Sources & evidence
- ORD record
- ord-4f185e6ad82844e690387f0b818f0032
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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