Dimethylformamide → 2-[(5-Methyl-3-phenyl-isoxazol-4-ylmethyl)-amino]-thiazole-5-carboxylic acid (tetra-hydro-pyran-4-yl)-amide
반응식
[CH3:1][c:2]1[c:3]([CH2:13][NH2:14])[c:4](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[n:5][o:6]1.[O:15]1[CH2:16][CH2:17][CH:18]([NH:21][C:22](=[O:23])[c:24]2[cH:25][n:26][c:27]([Cl:29])[s:28]2)[CH2:19][CH2:20]1.[O:30]=[CH:31][N:32]([CH3:33])[CH3:34]>>[CH3:1][c:2]1[c:3]([CH2:13][NH:14][c:27]2[n:26][cH:25][c:24]([C:22]([NH:21][CH:18]3[CH2:17][CH2:16][O:15][CH2:20][CH2:19]3)=[O:23])[s:28]2)[c:4](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[n:5][o:6]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-38aef1f4897a4152a13b8228ea90db3d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
반응 노트
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