1,2-Dichloroethane → 5-Phenyl-oxazole-4-carboxylic acid (2-{2-[1-(tert-butyl-dimethyl-silanyloxy)-ethyl]-oxazol-5-ylmethyl}-2H-[1,2,3]triazol-4-yl)-amide
반응식
[C:31]([CH3:32])([CH3:33])([CH3:34])[Si:35]([O:36][CH:37]([CH3:38])[c:39]1[o:40][c:41]([CH2:44][n:45]2[n:46][cH:47][c:48]([NH2:50])[n:49]2)[cH:42][n:43]1)([CH3:51])[CH3:52].[CH2:27]([Cl:28])[CH2:29][Cl:30].[CH3:56][N:57]([c:58]1[cH:59][cH:60][n:61][cH:62][cH:63]1)[CH3:64].[Cl:53][CH2:54][Cl:55].[N:1]#[N:2].[OH2:65].[OH:17][n:18]1[c:19]2[c:20]([cH:21][cH:22][cH:23][cH:24]2)[n:25][n:26]1.[c:3]1(-[c:9]2[c:10]([C:14](=[O:15])[OH:16])[n:11][cH:12][o:13]2)[cH:4][cH:5][cH:6][cH:7][cH:8]1>>[c:3]1(-[c:9]2[c:10]([C:14](=[O:16])[NH:50][c:48]3[cH:47][n:46][n:45]([CH2:44][c:41]4[o:40][c:39]([CH:37]([O:36][Si:35]([C:31]([CH3:32])([CH3:33])[CH3:34])([CH3:51])[CH3:52])[CH3:38])[n:43][cH:42]4)[n:49]3)[n:11][cH:12][o:13]2)[cH:4][cH:5][cH:6][cH:7][cH:8]1참가 물질
9
반응물 8
생성물 1
출처 및 근거
- ORD 기록
- ord-5f5a85e4888e46d98011095a6bed435b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
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