Chloroform → N-{4-[(6,7-Dimethoxy-4-quinolyl)oxy]-2-fluorophenyl}-N'-[1-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]urea
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[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][c:18]([F:23])[c:19]([NH2:20])[cH:21][cH:22]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:24][CH2:25][N:26]([CH2:27][CH3:28])[CH2:29][CH3:30].[CH3:43][c:44]1[n:45][c:46]([CH:50]([CH3:51])[NH2:52])[s:47][c:48]1[CH3:49].[CH:53]([Cl:54])([Cl:55])[Cl:56].[Cl:31][C:32]([Cl:33])([O:34][C:35]([O:36][C:37]([Cl:38])([Cl:39])[Cl:40])=[O:41])[Cl:42]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][c:18]([F:23])[c:19]([NH:20][C:35](=[O:41])[NH:52][CH:50]([c:46]4[n:45][c:44]([CH3:43])[c:48]([CH3:49])[s:47]4)[CH3:51])[cH:21][cH:22]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]참가 물질
6
출처 및 근거
- ORD 기록
- ord-f523e3eb18b34d3c85a42a3ffdfa8496
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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