Cumene → N-[6-chloro-5-(p-methoxyphenyl)-4-pyrimidinyl]-p-isopropylbenzenesulfonamide
반응식
[CH3:14][CH:15]([c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)[CH3:22].[CH:1]([c:2]1[cH:3][cH:4][c:5]([S:6]([Cl:7])(=[O:8])=[O:9])[cH:10][cH:11]1)([CH3:12])[CH3:13].[CH:40]([CH3:41])([CH3:42])[c:43]1[cH:44][cH:45][c:46]([S:49](=[O:50])(=[O:51])[NH2:52])[cH:47][cH:48]1.[Cl:23][c:24]1[n:25][cH:26][n:27][c:28]([Cl:38])[c:29]1-[c:30]1[cH:31][cH:32][c:33]([O:36][CH3:37])[cH:34][cH:35]1.[K:39]>>[c:24]1([NH:52][S:49]([c:46]2[cH:45][cH:44][c:43]([CH:40]([CH3:41])[CH3:42])[cH:48][cH:47]2)(=[O:50])=[O:51])[n:25][cH:26][n:27][c:28]([Cl:38])[c:29]1-[c:30]1[cH:31][cH:32][c:33]([O:36][CH3:37])[cH:34][cH:35]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-45163be89b094d4ab5940f93ece32003
- 출처 데이터셋
- Test data from https://doi.org/10.1039/C8SC04228D
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