1,2-Dichloroethane → 4-(4-Propan-2-ylphenyl)-6-prop-2-ynoxy-1-[2-(2,4,6-trimethylphenyl)ethenyl]quinazolin-2-one
반응식
[Cl:52][CH2:53][CH2:54][Cl:55].[F:37][C:38]([F:39])([F:40])[S:41]([O:42][S:43]([C:44]([F:45])([F:46])[F:47])(=[O:48])=[O:49])(=[O:50])=[O:51].[OH:1][CH:2]([CH2:3][n:4]1[c:5](=[O:27])[n:6][c:7](-[c:18]2[cH:19][cH:20][c:21]([CH:24]([CH3:25])[CH3:26])[cH:22][cH:23]2)[c:8]2[cH:9][c:10]([O:14][CH2:15][C:16]#[CH:17])[cH:11][cH:12][c:13]12)[c:28]1[c:29]([CH3:36])[cH:30][c:31]([CH3:35])[cH:32][c:33]1[CH3:34]>>[CH:2](=[CH:3][n:4]1[c:5](=[O:27])[n:6][c:7](-[c:18]2[cH:19][cH:20][c:21]([CH:24]([CH3:25])[CH3:26])[cH:22][cH:23]2)[c:8]2[cH:9][c:10]([O:14][CH2:15][C:16]#[CH:17])[cH:11][cH:12][c:13]12)[c:28]1[c:29]([CH3:36])[cH:30][c:31]([CH3:35])[cH:32][c:33]1[CH3:34]참가 물질
4
반응물 3
생성물 1
출처 및 근거
- ORD 기록
- ord-76c114114c6e44fb81ba993eb17eee0e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)