Methanol → Methyl 6-chloro-2-[2-cyano-2-({[4-(trifluoromethoxy)phenyl]carbonyl}-amino)propyl]-2H-benzotriazole-4-carboxylate
반응식
[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[CH3:1][Si:2]([CH:3]=[N+:4]=[N-:5])([CH3:6])[CH3:7].[CH3:45][OH:46].[Cl:8][c:9]1[cH:10][c:11]([C:37](=[O:38])[OH:39])[c:12]2[c:13]([n:14][n:15]([CH2:17][C:18]([CH3:19])([NH:20][C:21](=[O:22])[c:23]3[cH:24][cH:25][c:26]([O:29][C:30]([F:31])([F:32])[F:33])[cH:27][cH:28]3)[C:34]#[N:35])[n:16]2)[cH:36]1>>[CH3:1][O:39][C:37]([c:11]1[cH:10][c:9]([Cl:8])[cH:36][c:13]2[c:12]1[n:16][n:15]([CH2:17][C:18]([CH3:19])([NH:20][C:21](=[O:22])[c:23]1[cH:24][cH:25][c:26]([O:29][C:30]([F:31])([F:32])[F:33])[cH:27][cH:28]1)[C:34]#[N:35])[n:14]2)=[O:38]참가 물질
5
반응물 4
생성물 1
출처 및 근거
- ORD 기록
- ord-ba0b9b52f3de4de29f11583999901843
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
반응 노트
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