반응식
[CH:1]([CH3:2])([CH3:3])[N:4]([CH2:5][CH2:6][CH:7]([C:8]#[N:9])[c:10]1[cH:11][cH:12][cH:13][c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]12)[CH:20]([CH3:21])[CH3:22].[Cl:23][CH2:24][CH2:25][N:26]1[CH2:27][CH2:28][CH:29]([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[CH2:30][CH2:31]1.[Cl:62][CH2:63][CH2:64][N:65]([CH:66]([CH3:67])[CH3:68])[CH:69]([CH3:70])[CH3:71].[c:38]1(-[c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[cH:45][cH:46][c:47]([CH:48]([CH2:49][CH2:50][N:51]([CH:52]([CH3:53])[CH3:54])[CH:55]([CH3:56])[CH3:57])[C:58]#[N:59])[cH:60][cH:61]1>>[CH:1]([CH3:2])([CH3:3])[N:4]([CH2:5][CH2:6][C:7]([C:8]#[N:9])([c:10]1[cH:11][cH:12][cH:13][c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]12)[CH2:24][CH2:25][N:26]1[CH2:27][CH2:28][CH:29]([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[CH2:30][CH2:31]1)[CH:20]([CH3:21])[CH3:22]참가 물질
5
반응물 4
생성물 1
출처 및 근거
- ORD 기록
- ord-c45a44a37c6740f5888594754d8607e6
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
연결된 노트
불러오는 중…