Acetonitrile → 4-(1-Benzofuran-5-ylamino)-2-butyl-5-phenylisothiazol-3(2H)-one 1,1-dioxide
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[N:5]1[S:6](=[O:18])(=[O:19])[C:7]([c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)=[C:8]([Cl:11])[C:9]1=[O:10].[CH3:30][C:31]#[N:32].[o:20]1[cH:21][cH:22][c:23]2[c:24]1[cH:25][cH:26][c:27]([NH2:29])[cH:28]2>>[CH2:1]([CH2:2][CH2:3][CH3:4])[N:5]1[S:6](=[O:18])(=[O:19])[C:7]([c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)=[C:8]([NH:29][c:27]2[cH:26][cH:25][c:24]3[o:20][cH:21][cH:22][c:23]3[cH:28]2)[C:9]1=[O:10]Participants
4
Sources & evidence
- ORD record
- ord-0f180ef5d8f146578664a63c2bd8f7df
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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