1,4-Dioxane → 1-[3-[[5-Chloro-4-[(4-chlorophenylthio)-(2,5-difluorophenyl)methyl]pyridin-2-yl]amino]propyl]pyrrolidin-2-one
반응식
[CH2:36]1[O:37][CH2:38][CH2:39][O:40][CH2:41]1.[Cl:1][c:2]1[n:3][cH:4][c:5]([Cl:25])[c:6]([CH:8]([c:9]2[c:10]([F:16])[cH:11][cH:12][c:13]([F:15])[cH:14]2)[S:17][c:18]2[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]2)[cH:7]1.[NH2:26][CH2:27][CH2:28][CH2:29][N:30]1[C:31](=[O:35])[CH2:32][CH2:33][CH2:34]1>>[c:2]1([NH:26][CH2:27][CH2:28][CH2:29][N:30]2[C:31](=[O:35])[CH2:32][CH2:33][CH2:34]2)[n:3][cH:4][c:5]([Cl:25])[c:6]([CH:8]([c:9]2[c:10]([F:16])[cH:11][cH:12][c:13]([F:15])[cH:14]2)[S:17][c:18]2[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]2)[cH:7]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-ac88a0f359124997a002d5dc5a131947
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)