Ethanol → Ethyl 5-[[(amino)(imino)methyl]thiomethyl]-1,3-dimethyl-1H-pyrazole-4-carboxylate
반응식
[CH3:19][CH2:20][OH:21].[Cl:1][CH2:2][c:3]1[c:4]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[c:5]([CH3:9])[n:6][n:7]1[CH3:8].[NH2:15][C:16]([NH2:17])=[S:18]>>[CH2:2]([c:3]1[c:4]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[c:5]([CH3:9])[n:6][n:7]1[CH3:8])[S:18][C:16](=[NH:15])[NH2:17]참가 물질
4
출처 및 근거
- ORD 기록
- ord-2d654fadd2ae412496255fe7de34dbab
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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