Methanol → N-(1-{[3-(Aminomethyl)phenyl]methyl}-4-fluoro-1H-indazol-3-yl)-5-chloro-2-thiophenesulfonamide
반응식
[Al+3:31].[CH3:36][OH:37].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:7](=[O:8])(=[O:9])[NH:10][c:11]2[n:12][n:13]([CH2:21][c:22]3[cH:23][c:24]([C:28]#[N:29])[cH:25][cH:26][cH:27]3)[c:14]3[cH:15][cH:16][cH:17][c:18]([F:20])[c:19]23)[s:6]1.[H-:30].[H-:33].[H-:34].[H-:35].[Li+:32].[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:7](=[O:8])(=[O:9])[NH:10][c:11]2[n:12][n:13]([CH2:21][c:22]3[cH:23][c:24]([CH2:28][NH2:29])[cH:25][cH:26][cH:27]3)[c:14]3[cH:15][cH:16][cH:17][c:18]([F:20])[c:19]23)[s:6]1참가 물질
7
반응물 6
생성물 1
출처 및 근거
- ORD 기록
- ord-70ba8a10b4d9448f838c85499b45e7f1
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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