Acetic Acid → 4-[2-(4-Ethyl-1,3-thiazol-2-yl)-3-oxobut-1-en-1-yl]-3-methoxybenzonitrile
Reaction equation
[CH2:13]([CH3:14])[c:15]1[n:16][c:17]([CH2:20][C:21](=[O:22])[CH3:23])[s:18][cH:19]1.[CH2:24]1[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]1.[CH3:30][C:31](=[O:32])[OH:33].[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:34][CH2:35][Cl:36]>>[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:20]([c:17]1[n:16][c:15]([CH2:13][CH3:14])[cH:19][s:18]1)[C:21](=[O:22])[CH3:23]Participants
6
Sources & evidence
- ORD record
- ord-7a498326d4304a98818a5a820783ef81
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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