5-Amino-1,3-dihydro-2lambda6-benzothiophene-2,2-dione → 4-[(2,2-Dioxido-1,3-dihydro-2-benzothien-5-yl)amino]-6-methyl-2-(methylthio)-5-pyrimidinecarbonitrile
Reaction equation
[Cl:1][c:2]1[n:3][c:4]([S:11][CH3:12])[n:5][c:6]([CH3:10])[c:7]1[C:8]#[N:9].[O:13]=[S:14]1(=[O:24])[CH2:15][c:16]2[c:17]([cH:19][cH:20][c:21]([NH2:23])[cH:22]2)[CH2:18]1>>[c:2]1([NH:23][c:21]2[cH:20][cH:19][c:17]3[c:16]([cH:22]2)[CH2:15][S:14](=[O:13])(=[O:24])[CH2:18]3)[n:3][c:4]([S:11][CH3:12])[n:5][c:6]([CH3:10])[c:7]1[C:8]#[N:9]Participants
3
Sources & evidence
- ORD record
- ord-4edf443adb564c08b0474eeabfafa6d2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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