Acetonitrile → 5-chloro-2,4-difluoro-N-pyridazin-3-ylbenzenesulfonamide
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[CH3:21][C:22]#[N:23].[Cl:8][c:9]1[c:10]([F:20])[cH:11][c:12]([F:19])[c:13]([S:15](=[O:16])(=[O:17])[Cl:18])[cH:14]1.[n:1]1[n:2][c:3]([NH2:7])[cH:4][cH:5][cH:6]1>>[n:1]1[n:2][c:3]([NH:7][S:15]([c:13]2[c:12]([F:19])[cH:11][c:10]([F:20])[c:9]([Cl:8])[cH:14]2)(=[O:16])=[O:17])[cH:4][cH:5][cH:6]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-29bb1440a37c4e88bf00ab403bb2309f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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