Sodium Ion → 3-[4-Chloro-6-fluoro-2-propoxybenzothiazol-7-yl]-6-trifluoromethyl-2,4(1H,3H)-pyrimidinedione
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[CH2:1]([CH2:2][CH3:3])[OH:4].[Cl:7][c:8]1[s:9][c:10]2[c:11]([n:12]1)[c:13]([Cl:30])[cH:14][c:15]([F:29])[c:16]2-[n:17]1[c:18](=[O:28])[nH:19][c:20]([C:24]([F:25])([F:26])[F:27])[cH:21][c:22]1=[O:23].[H-:5].[Na+:6].[O:31]1[CH2:32][CH2:33][CH2:34][CH2:35]1>>[CH2:1]([CH2:2][CH3:3])[O:4][c:8]1[s:9][c:10]2[c:11]([n:12]1)[c:13]([Cl:30])[cH:14][c:15]([F:29])[c:16]2-[n:17]1[c:18](=[O:28])[nH:19][c:20]([C:24]([F:25])([F:26])[F:27])[cH:21][c:22]1=[O:23]참가 물질
6
출처 및 근거
- ORD 기록
- ord-426e20c41e7d454eb6e12ef24b37b34f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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