Diethyl Ether → 5-[4-(isobutylamino)-3-nitrophenyl]-6-methyl-3,6-dihydro-2H-1,3,4-thiadiazin-2-one
Reaction equation
[CH2:22]([CH:23]([CH3:24])[CH3:25])[NH2:26].[CH3:1][C:2]#[N:3].[CH3:27][CH2:28][O:29][CH2:30][CH3:31].[Cl:4][c:5]1[c:6]([N+:19](=[O:20])[O-:21])[cH:7][c:8]([C:11]2=[N:12][NH:13][C:14](=[O:18])[S:15][CH:16]2[CH3:17])[cH:9][cH:10]1>>[c:5]1([NH:26][CH2:22][CH:23]([CH3:24])[CH3:25])[c:6]([N+:19](=[O:20])[O-:21])[cH:7][c:8]([C:11]2=[N:12][NH:13][C:14](=[O:18])[S:15][CH:16]2[CH3:17])[cH:9][cH:10]1Participants
5
Sources & evidence
- ORD record
- ord-b8ffb09372704e9ea2668c0b85fdc437
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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