Imidazole → Benzyl 4-(4-imidazol-1-ylmethylphenyl)-3-[4-(3-methoxypropyl)-3,4-dihydro-2H-benzo[1,4]oxazin-6-ylmethoxy]piperidine-1-carboxylate
반응식
[Cl:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([CH:9]2[CH:10]([O:25][CH2:26][c:27]3[cH:28][cH:29][c:30]4[c:31]([cH:41]3)[N:32]([CH2:36][CH2:37][CH2:38][O:39][CH3:40])[CH2:33][CH2:34][O:35]4)[CH2:11][N:12]([C:15](=[O:16])[O:17][CH2:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[CH2:13][CH2:14]2)[cH:7][cH:8]1.[nH:42]1[cH:43][n:44][cH:45][cH:46]1>>[CH2:2]([c:3]1[cH:4][cH:5][c:6]([CH:9]2[CH:10]([O:25][CH2:26][c:27]3[cH:28][cH:29][c:30]4[c:31]([cH:41]3)[N:32]([CH2:36][CH2:37][CH2:38][O:39][CH3:40])[CH2:33][CH2:34][O:35]4)[CH2:11][N:12]([C:15](=[O:16])[O:17][CH2:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[CH2:13][CH2:14]2)[cH:7][cH:8]1)[n:42]1[cH:43][n:44][cH:45][cH:46]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-674c109810bc40c4bea23d8711c2bf5d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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