Hydrogen Bromide → 4-(3-{4-[(benzyl{2-methyl-3-[(methylsulfonyl)amino]phenyl}amino)methyl]phenoxy}phenoxy)-N-(2-oxotetrahydrofuran-3-yl)butanamide
반응식
[BrH:42].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([c:9]1[c:10]([CH3:20])[c:11]([NH:15][S:16](=[O:17])(=[O:18])[CH3:19])[cH:12][cH:13][cH:14]1)[CH2:21][c:22]1[cH:23][cH:24][c:25]([O:26][c:27]2[cH:28][c:29]([O:30][CH2:31][CH2:32][CH2:33][C:34](=[O:35])[OH:36])[cH:37][cH:38][cH:39]2)[cH:40][cH:41]1.[NH2:43][CH:44]1[C:45](=[O:46])[O:47][CH2:48][CH2:49]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([c:9]1[c:10]([CH3:20])[c:11]([NH:15][S:16](=[O:17])(=[O:18])[CH3:19])[cH:12][cH:13][cH:14]1)[CH2:21][c:22]1[cH:23][cH:24][c:25]([O:26][c:27]2[cH:28][c:29]([O:30][CH2:31][CH2:32][CH2:33][C:34](=[O:35])[NH:43][CH:44]3[C:45](=[O:46])[O:47][CH2:48][CH2:49]3)[cH:37][cH:38][cH:39]2)[cH:40][cH:41]1참가 물질
4
반응물 3
생성물 1
출처 및 근거
- ORD 기록
- ord-1fed52a013354b7bb17135ca79b0244f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)