Dietylaminopropin → N-(3-chloro-4-(2-(3-(diethylamino)prop-1-ynyl)thieno[3,2-b]pyridin-7-yloxy)phenyl)-N-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide
반응식
[CH2:35]([CH3:36])[N:37]([CH2:38][C:39]#[CH:40])[CH2:41][CH3:42].[Cl:1][c:2]1[cH:3][c:4]([N:19]([C:20](=[O:21])[C:22]2([C:25](=[O:26])[NH2:27])[CH2:23][CH2:24]2)[c:28]2[cH:29][cH:30][c:31]([F:34])[cH:32][cH:33]2)[cH:5][cH:6][c:7]1[O:8][c:9]1[c:10]2[c:11]([n:12][cH:13][cH:14]1)[cH:15][c:16]([I:18])[s:17]2>>[Cl:1][c:2]1[cH:3][c:4]([N:19]([C:20](=[O:21])[C:22]2([C:25](=[O:26])[NH2:27])[CH2:23][CH2:24]2)[c:28]2[cH:29][cH:30][c:31]([F:34])[cH:32][cH:33]2)[cH:5][cH:6][c:7]1[O:8][c:9]1[c:10]2[c:11]([n:12][cH:13][cH:14]1)[cH:15][c:16]([C:40]#[C:39][CH2:38][N:37]([CH2:35][CH3:36])[CH2:41][CH3:42])[s:17]2참가 물질
3
출처 및 근거
- ORD 기록
- ord-aedb1a11b4b64688ad1a9a7a67309ab0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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