1,2-Benzisothiazol-3(2H)-one → 3-Oxo-3H-benzo[d]isothiazole-2-carboxylic acid hexylamide
반응식
[CH2:11]([CH2:12][CH2:13][CH2:14][CH2:15][CH3:16])[N:17]=[C:18]=[O:19].[O:1]=[c:2]1[nH:3][s:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12>>[O:1]=[c:2]1[n:3]([C:18]([NH:17][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH3:16])=[O:19])[s:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12참가 물질
3
출처 및 근거
- ORD 기록
- ord-5eece0d8c0c649a08a8f76d914b45fd1
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
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