Citric Acid → n-Propanesulfonic acid [6-[2-(5-methylsulfanyl-pyrimidin-2-yloxy)-ethoxy]-5-(2-methoxy-phenoxy)-[2,2']bipyrimidinyl-4-yl]-amide
반응식
[CH2:57]1[O:58][CH2:59][CH2:60][CH2:61]1.[Cl:35][c:36]1[n:37][cH:38][c:39]([S:42][CH3:43])[cH:40][n:41]1.[H-:33].[Na+:34].[OH:1][CH2:2][CH2:3][O:4][c:5]1[c:6]([O:24][c:25]2[c:26]([O:31][CH3:32])[cH:27][cH:28][cH:29][cH:30]2)[c:7]([NH:17][S:18](=[O:19])(=[O:20])[CH2:21][CH2:22][CH3:23])[n:8][c:9](-[c:11]2[n:12][cH:13][cH:14][cH:15][n:16]2)[n:10]1.[OH:44][C:45]([CH2:46][C:47]([C:48](=[O:49])[OH:50])([CH2:51][C:52](=[O:53])[OH:54])[OH:55])=[O:56]>>[O:1]([CH2:2][CH2:3][O:4][c:5]1[c:6]([O:24][c:25]2[c:26]([O:31][CH3:32])[cH:27][cH:28][cH:29][cH:30]2)[c:7]([NH:17][S:18](=[O:19])(=[O:20])[CH2:21][CH2:22][CH3:23])[n:8][c:9](-[c:11]2[n:12][cH:13][cH:14][cH:15][n:16]2)[n:10]1)[c:36]1[n:37][cH:38][c:39]([S:42][CH3:43])[cH:40][n:41]1참가 물질
7
반응물 6
생성물 1
출처 및 근거
- ORD 기록
- ord-e43e7fbfd987498ea2b2ee2aaccc5dcf
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
반응 노트
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