1-Butanol → 2-(4-Hexylphenyl)-5-[4-(3-trimethylsilylpropoxy)phenyl]-1,3-thiazole
반응식
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH3:6])[c:7]1[cH:8][cH:9][c:10](-[c:13]2[s:14][c:15](-[c:18]3[cH:19][cH:20][c:21]([OH:24])[cH:22][cH:23]3)[cH:16][n:17]2)[cH:11][cH:12]1.[CH2:25]([OH:26])[CH2:27][CH2:28][CH3:29].[OH2:48].[c:30]1([CH3:31])[cH:32][cH:33][c:34]([S:35]([O:36][CH2:40][CH2:41][CH2:42][Si:43]([CH3:44])([CH3:45])[CH3:46])(=[O:37])=[O:38])[cH:39][cH:47]1>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH3:6])[c:7]1[cH:8][cH:9][c:10](-[c:13]2[s:14][c:15](-[c:18]3[cH:19][cH:20][c:21]([O:24][CH2:40][CH2:41][CH2:42][Si:43]([CH3:44])([CH3:45])[CH3:46])[cH:22][cH:23]3)[cH:16][n:17]2)[cH:11][cH:12]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-602aec6d881d451cb1a6f9771e1bfc11
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)