Ethanol → 4-[N-(4-aminophenyl)-N-(4-bromobenzyl)amino]-4H-1,2,4-triazole
반응식
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]([c:8]2[cH:9][cH:10][c:11]([N+:14]([O-:15])=[O:16])[cH:12][cH:13]2)[n:17]2[cH:18][n:19][n:20][cH:21]2)[cH:22][cH:23]1.[CH3:26][CH2:27][OH:28].[H:24][H:25]>>[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][N:7]([c:8]2[cH:9][cH:10][c:11]([NH2:14])[cH:12][cH:13]2)[n:17]2[cH:18][n:19][n:20][cH:21]2)[cH:22][cH:23]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-74c98c7956134328a11d55885ce0e78f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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