Water → 1-[5-Amino-3-chloro-2-(5-trifluoromethyl-benzothiazol-2-ylsulfanyl)phenyl]-ethanone
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[Cl:1][c:2]1[c:3]([S:14][c:15]2[s:16][c:17]3[c:18]([n:19]2)[cH:20][c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]3)[c:4]([C:11]([CH3:12])=[O:13])[cH:5][c:6]([N+:8]([O-:9])=[O:10])[cH:7]1.[OH2:28].[OH2:29].[Sn:30]([Cl:31])([Cl:32])([Cl:33])[Cl:34]>>[Cl:1][c:2]1[c:3]([S:14][c:15]2[s:16][c:17]3[c:18]([n:19]2)[cH:20][c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]3)[c:4]([C:11]([CH3:12])=[O:13])[cH:5][c:6]([NH2:8])[cH:7]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-1f29f1e00eed4a3ea1ff0b9f03e1ba0b
- 출처 데이터셋
- Validation data from https://doi.org/10.1039/C8SC04228D
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