Acetic Acid → 3-Methoxy-4-[4-methoxy-2-(4-methyl-1,3-thiazol-2-yl)-3-oxobut-1-en-1-yl]benzonitrile
Reaction equation
[CH2:25]1[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]1.[CH3:13][O:14][CH2:15][C:16](=[O:17])[CH2:18][c:19]1[s:20][cH:21][c:22]([CH3:24])[n:23]1.[CH3:31][C:32](=[O:33])[OH:34].[CH:1](=[O:2])[c:3]1[c:4]([O:11][CH3:12])[cH:5][c:6]([C:7]#[N:8])[cH:9][cH:10]1.[Cl:35][CH2:36][Cl:37]>>[CH:1]([c:3]1[c:4]([O:11][CH3:12])[cH:5][c:6]([C:7]#[N:8])[cH:9][cH:10]1)=[C:18]([C:16]([CH2:15][O:14][CH3:13])=[O:17])[c:19]1[s:20][cH:21][c:22]([CH3:24])[n:23]1Participants
6
Sources & evidence
- ORD record
- ord-55f24cdd0efe4874bb03c8051e60b64d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
Loading…