Tetrahydrofuran → N-((7-bromo-4-fluoro-9-(2-hydroxyethyl)-2-methoxy-9H-xanthen-9-yl)carbamothioyl)benzamide
반응식
[C:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)(=[O:30])[N:31]=[C:32]=[S:33].[CH2:34]1[O:35][CH2:36][CH2:37][CH2:38]1.[NH2:1][C:2]1([CH2:20][CH2:21][OH:22])[c:3]2[cH:4][c:5]([Br:19])[cH:6][cH:7][c:8]2[O:9][c:10]2[c:11]([F:18])[cH:12][c:13]([O:16][CH3:17])[cH:14][c:15]21>>[NH:1]([C:2]1([CH2:20][CH2:21][OH:22])[c:3]2[cH:4][c:5]([Br:19])[cH:6][cH:7][c:8]2[O:9][c:10]2[c:11]([F:18])[cH:12][c:13]([O:16][CH3:17])[cH:14][c:15]21)[C:32]([NH:31][C:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)=[O:30])=[S:33]참가 물질
4
출처 및 근거
- ORD 기록
- ord-6e3103b6308b47a894e024e9731ac954
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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