Tetrahydrofuran → 2-Phenoxymethyl-1-(4-trifluoromethoxy-benzyl)-1H-benzoimidazole-5-carboxylic acid (3-butoxy-propyl)-amide
반응식
[CH2:33]([CH2:34][CH2:35][CH3:36])[O:37][CH2:38][CH2:39][CH2:40][NH2:41].[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH2:8][c:9]1[n:10][c:11]2[c:12]([n:13]1[CH2:14][c:15]1[cH:16][cH:17][c:18]([O:21][C:22]([F:23])([F:24])[F:25])[cH:19][cH:20]1)[cH:26][cH:27][c:28]([C:30](=[O:31])[OH:32])[cH:29]2>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH2:8][c:9]1[n:10][c:11]2[c:12]([n:13]1[CH2:14][c:15]1[cH:16][cH:17][c:18]([O:21][C:22]([F:23])([F:24])[F:25])[cH:19][cH:20]1)[cH:26][cH:27][c:28]([C:30](=[O:31])[NH:41][CH2:40][CH2:39][CH2:38][O:37][CH2:33][CH2:34][CH2:35][CH3:36])[cH:29]2참가 물질
4
출처 및 근거
- ORD 기록
- ord-39add30d48b4455d9f221024b1909057
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)