1,2-Benzisothiazol-3(2H)-one → 3-Oxo-3H-benzo[d]isothiazole-2-carboxylic acid 4-methyl-benzylamide
반응식
[CH3:11][c:12]1[cH:13][cH:14][c:15]([CH2:16][N:17]=[C:18]=[O:19])[cH:20][cH:21]1.[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][CH2:16][c:15]2[cH:14][cH:13][c:12]([CH3:11])[cH:21][cH:20]2)=[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-2cae5ca06839463a81995ba2543e887f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
불러오는 중…