Water → 3-(6-Bromo-4-methyl-3,5-dioxo-4,5-dihydro-3H-[1,2,4]triazin-2-yl)-propionitrile
반응식
[Br:1][c:2]1[c:3](=[O:10])[n:4]([CH3:9])[c:5](=[O:8])[nH:6][n:7]1.[CH2:11]=[CH:12][C:13]#[N:14].[OH2:21].[cH:15]1[cH:16][cH:17][n:18][cH:19][cH:20]1>>[Br:1][c:2]1[c:3](=[O:10])[n:4]([CH3:9])[c:5](=[O:8])[n:6]([CH2:11][CH2:12][C:13]#[N:14])[n:7]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-24c667f15d9340909c87c3357a232233
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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