m-Toluenesulphonamide → N-[({2-[4-(3,5-Dimethyl-4-phenyl-1H-pyrazol-1-yl)phenyl]ethyl}amino)carbonyl]-3-methylbenzenesulfonamide
반응식
[CH3:1][c:2]1[n:3][n:4](-[c:14]2[cH:15][cH:16][c:17]([CH2:20][CH2:21][NH:22][C:23]([O:24][c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)=[O:25])[cH:18][cH:19]2)[c:5]([CH3:13])[c:6]1-[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1.[CH3:32][c:33]1[cH:34][c:35]([S:39](=[O:40])(=[O:41])[NH2:42])[cH:36][cH:37][cH:38]1>>[CH3:1][c:2]1[n:3][n:4](-[c:14]2[cH:15][cH:16][c:17]([CH2:20][CH2:21][NH:22][C:23](=[O:24])[NH:42][S:39]([c:35]3[cH:34][c:33]([CH3:32])[cH:38][cH:37][cH:36]3)(=[O:40])=[O:41])[cH:18][cH:19]2)[c:5]([CH3:13])[c:6]1-[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-fe463347a8304da8aa16c84a08cbc8d8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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