N-(2-t-Butoxycarbonylaminophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide → N-(2-t-butoxycarbonylaminophenyl)-4-[2-(2-pyrrolidin-1-ylethoxy)pyrimidin-5-yl]benzamide
반응식
[Br:33][c:34]1[cH:35][n:36][c:37]([O:40][CH2:41][CH2:42][N:43]2[CH2:44][CH2:45][CH2:46][CH2:47]2)[n:38][cH:39]1.[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[c:10]([NH:15][C:16]([c:17]2[cH:18][cH:19][c:20]([B:23]3[O:24][C:25]([CH3:26])([CH3:27])[C:28]([CH3:29])([CH3:30])[O:31]3)[cH:21][cH:22]2)=[O:32])[cH:11][cH:12][cH:13][cH:14]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[c:10]([NH:15][C:16]([c:17]2[cH:18][cH:19][c:20](-[c:34]3[cH:35][n:36][c:37]([O:40][CH2:41][CH2:42][N:43]4[CH2:44][CH2:45][CH2:46][CH2:47]4)[n:38][cH:39]3)[cH:21][cH:22]2)=[O:32])[cH:11][cH:12][cH:13][cH:14]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-37ecdea0a1404a179907548889b4a502
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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