5,11-Dihydro-11-ethyl-5-methyl-2-trifluoromethanesulfonyloxy-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one → 5,11-Dihydro-11-ethyl-2-(1-ethylpyrazol-4-yl)-5-methyl-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
반응식
[CH2:1]([CH3:2])[N:3]1[c:4]2[c:5]([cH:16][cH:17][c:18]([O:20][S:21]([C:22]([F:23])([F:24])[F:25])(=[O:26])=[O:27])[n:19]2)[N:6]([CH3:15])[C:7](=[O:14])[c:8]2[c:9]1[n:10][cH:11][cH:12][cH:13]2.[CH2:28]([CH3:29])[n:30]1[n:31][cH:32][c:33]([I:35])[cH:34]1>>[CH2:1]([CH3:2])[N:3]1[c:4]2[c:5]([cH:16][cH:17][c:18](-[c:33]3[cH:32][n:31][n:30]([CH2:28][CH3:29])[cH:34]3)[n:19]2)[N:6]([CH3:15])[C:7](=[O:14])[c:8]2[c:9]1[n:10][cH:11][cH:12][cH:13]2참가 물질
3
출처 및 근거
- ORD 기록
- ord-46df18f6fc43472091d559d51fe54869
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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