반응식
[CH3:38][N:39]([CH3:40])[CH2:41][CH2:42][CH2:43][N:44]=[C:45]=[N:46][CH2:47][CH3:48].[CH3:50][N:51]([CH3:52])[c:53]1[cH:54][cH:55][n:56][cH:57][cH:58]1.[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[C:9]([C:19](=[O:20])[O:21][CH2:22][CH2:23][C:24]#[N:25])=[C:10]([CH3:18])[NH:11][C:12]([CH3:17])=[C:13]2[C:14](=[O:15])[O-:16])[cH:5][cH:6][cH:7]1.[Cl:59][CH2:60][Cl:61].[ClH:37].[OH2:49].[c:26]1([CH:32]2[CH:33]([CH2:35][OH:36])[CH2:34]2)[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[C:9]([C:19](=[O:20])[O:21][CH2:22][CH2:23][C:24]#[N:25])=[C:10]([CH3:18])[NH:11][C:12]([CH3:17])=[C:13]2[C:14](=[O:15])[O:16][CH2:35][CH:33]2[CH:32]([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[CH2:34]2)[cH:5][cH:6][cH:7]1참가 물질
8
반응물 7
생성물 1
출처 및 근거
- ORD 기록
- ord-169d75a79d434c08a77c10a61859764a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…