Dimethyl Sulfoxide → 4-{2-[(1,1-Dimethyl-2-oxoethyl)amino]-1,3-thiazol-4-yl}benzonitrile
반응식
[CH2:37]([Cl:38])[Cl:39].[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[CH3:7][S:8](=[O:9])[CH3:10].[Cl:1][C:2]([C:3]([Cl:4])=[O:5])=[O:6].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[OH:11][CH2:12][C:13]([CH3:14])([CH3:15])[NH:16][c:17]1[s:18][cH:19][c:20](-[c:22]2[cH:23][cH:24][c:25]([C:26]#[N:27])[cH:28][cH:29]2)[n:21]1>>[O:11]=[CH:12][C:13]([CH3:14])([CH3:15])[NH:16][c:17]1[s:18][cH:19][c:20](-[c:22]2[cH:23][cH:24][c:25]([C:26]#[N:27])[cH:28][cH:29]2)[n:21]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-73153a1d95504684a145aa7efaad35da
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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