3-Butylamino-4-phenoxy-5-sulphamyl-benzamide → (4-Benzyl-3-n-butoxy-5-sulfamylbenzyl)-2-diethylaminoethylamine
반응식
[CH2:1]([NH:2][c:3]1[cH:4][c:5]([C:20]([NH2:21])=[O:22])[cH:6][c:7]([S:8](=[O:9])(=[O:10])[NH2:11])[c:12]1[O:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[CH2:23][CH2:24][CH3:25].[CH2:26]([c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[c:33]1[c:34]([O:53][CH2:54][CH2:55][CH2:56][CH3:57])[cH:35][c:36]([C:37](=[O:38])[NH:39][CH2:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46])[cH:47][c:48]1[S:49]([NH2:50])(=[O:51])=[O:52]>>[CH2:26]([c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[c:33]1[c:34]([O:53][CH2:54][CH2:55][CH2:56][CH3:57])[cH:35][c:36]([CH2:37][NH:39][CH2:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46])[cH:47][c:48]1[S:49]([NH2:50])(=[O:51])=[O:52]참가 물질
3
출처 및 근거
- ORD 기록
- ord-708a241cb1974a6ab9c1e3fc366d85f4
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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