Ethanol → 6-Thioureido-nicotinic acid ethyl ester
반응식
[C:13](=[O:14])([c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)[N:21]=[C:22]=[S:23].[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][n:7][c:8]([NH2:11])[cH:9][cH:10]1)=[O:12].[CH2:28]1[O:29][CH2:30][CH2:31][CH2:32]1.[CH3:25][CH2:26][O-:27].[CH3:33][CH2:34][OH:35].[Na+:24]>>[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][n:7][c:8]([NH:11][C:22]([NH2:21])=[S:23])[cH:9][cH:10]1)=[O:12]참가 물질
7
출처 및 근거
- ORD 기록
- ord-f375a7436c3f495a9e94ff967e4f5d08
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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