반응식
[CH3:1][N:2]1[CH2:3][c:4]2[cH:5][c:6]([NH2:12])[cH:7][cH:8][c:9]2[CH2:10][CH2:11]1.[Cl:13][c:14]1[n:15][cH:16][c:17]2[c:18]([n:19]1)[nH:20][c:21](=[O:34])[n:22](-[c:25]1[c:26]([Cl:33])[cH:27][c:28]([F:32])[cH:29][c:30]1[Cl:31])[c:23]2=[NH:24].[Cl:35][c:36]1[n:37][c:38]2[nH:39][c:40](=[O:41])[n:42](-[c:43]3[c:44]([Cl:45])[cH:46][cH:47][cH:48][c:49]3[Cl:50])[c:51](=[NH:52])[c:53]2[cH:54][n:55]1>>[CH3:1][N:2]1[CH2:3][c:4]2[cH:5][c:6]([NH:12][c:14]3[n:15][cH:16][c:17]4[c:18]([n:19]3)[nH:20][c:21](=[O:34])[n:22](-[c:25]3[c:26]([Cl:33])[cH:27][c:28]([F:32])[cH:29][c:30]3[Cl:31])[c:23]4=[NH:24])[cH:7][cH:8][c:9]2[CH2:10][CH2:11]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-fcabe364794448e6abb7c77255a4059f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…