Dimethyl Sulfoxide → Ethyl 1-{[4-(2-methyl-1,2,3,4-tetraazol-5-yl)phenyl]methyl}piperidine-4-carboxylate
반응식
[Br:21][CH2:22][c:23]1[cH:24][cH:25][c:26](-[c:29]2[n:30][n:31][n:32]([CH3:34])[n:33]2)[cH:27][cH:28]1.[CH3:35][S:36]([CH3:37])=[O:38].[CH3:39][OH:40].[CH3:41][CH2:42][O:43][C:44](=[O:45])[CH3:46].[CH:12]([N:13]([CH2:14][CH3:15])[CH:16]([CH3:17])[CH3:18])([CH3:19])[CH3:20].[NH:1]1[CH2:2][CH2:3][CH:4]([C:5](=[O:6])[O:7][CH2:8][CH3:9])[CH2:10][CH2:11]1>>[N:1]1([CH2:22][c:23]2[cH:24][cH:25][c:26](-[c:29]3[n:30][n:31][n:32]([CH3:34])[n:33]3)[cH:27][cH:28]2)[CH2:2][CH2:3][CH:4]([C:5](=[O:6])[O:7][CH2:8][CH3:9])[CH2:10][CH2:11]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-5bdcbca134914c7cb1c3eb4bd1bed8f2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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