Acetone → N-{4-(2-{4-[(aminocarbonothioyl)amino]phenyl}ethyl)-5-[4-(methylsulfonyl)benzyl]-1,3-thiazol-2-yl}acetamide
Reaction equation
[C:30](=[O:31])([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[N:38]=[C:39]=[S:40].[CH3:42][C:43](=[O:44])[CH3:45].[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][c:10]2[n:11][c:12]([NH:26][C:27]([CH3:28])=[O:29])[s:13][c:14]2[CH2:15][c:16]2[cH:17][cH:18][c:19]([S:22](=[O:23])(=[O:24])[CH3:25])[cH:20][cH:21]2)[cH:6][cH:7]1.[OH2:41]>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][c:10]2[n:11][c:12]([NH:26][C:27]([CH3:28])=[O:29])[s:13][c:14]2[CH2:15][c:16]2[cH:17][cH:18][c:19]([S:22](=[O:23])(=[O:24])[CH3:25])[cH:20][cH:21]2)[cH:6][cH:7]1)[C:39]([NH2:38])=[S:40]Participants
5
Sources & evidence
- ORD record
- ord-693acc66295042d6868eafb713a67ea0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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