반응식
[CH3:28][N:29]([CH3:30])[CH:31]=[O:32].[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[Cl:20][CH:21]([C:22](=[O:23])[O:24][CH2:25][CH3:26])[CH3:27].[Cl:3][c:4]1[cH:5][c:6]2[c:15]([cH:16][cH:17]1)[NH:14][c:13]1[c:8]([cH:9][cH:10][c:11]([C:18]#[N:19])[cH:12]1)[S:7]2.[H-:1].[Na+:2]>>[Cl:3][c:4]1[cH:5][c:6]2[c:15]([cH:16][cH:17]1)[N:14]([CH:21]([C:22](=[O:23])[O:24][CH2:25][CH3:26])[CH3:27])[c:13]1[c:8]([cH:9][cH:10][c:11]([C:18]#[N:19])[cH:12]1)[S:7]2참가 물질
7
출처 및 근거
- ORD 기록
- ord-25b11fe23c924572972d414ce11884d6
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…