Ethyl Acetate → 3-[3-(4,4-dibutyl-7-fluoro-1-hydroxy-3-oxo-3,4-dihydronaphthalen-2-yl)-1,1-dioxido-4H-1,2,4-benzothiadiazin-7-yl]propanamide
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[C:5]1([CH2:35][CH2:36][CH2:37][CH3:38])[C:6](=[O:34])[C:7]([C:17]2=[N:18][S:19](=[O:32])(=[O:33])[c:20]3[c:21]([cH:23][cH:24][c:25]([CH:27]=[CH:28][C:29](=[O:30])[NH2:31])[cH:26]3)[NH:22]2)=[C:8]([OH:16])[c:9]2[cH:10][c:11]([F:15])[cH:12][cH:13][c:14]21.[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[C:5]1([CH2:35][CH2:36][CH2:37][CH3:38])[C:6](=[O:34])[C:7]([C:17]2=[N:18][S:19](=[O:32])(=[O:33])[c:20]3[c:21]([cH:23][cH:24][c:25]([CH2:27][CH2:28][C:29](=[O:30])[NH2:31])[cH:26]3)[NH:22]2)=[C:8]([OH:16])[c:9]2[cH:10][c:11]([F:15])[cH:12][cH:13][c:14]21Participants
3
Reactant 2
Product 1
Sources & evidence
- ORD record
- ord-d2bc216e5a2f476e9be938eafd7e88c4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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