Dimethylacetamide → 3-({[6-(1,1-dioxido-4H-1,2,4-benzothiadiazin-3-yl)-7-hydroxy-5-oxothieno[3,2-b]pyridin-4(5H)-yl]imino}methyl)benzonitrile
반응식
[CH3:35][N:36]([CH3:37])[C:38](=[O:39])[CH3:40].[CH:25](=[O:26])[c:27]1[cH:28][c:29]([C:30]#[N:31])[cH:32][cH:33][cH:34]1.[NH2:1][n:2]1[c:3]2[c:4]([c:5]([OH:21])[c:6]([C:9]3=[N:10][S:11](=[O:19])(=[O:20])[c:12]4[c:13]([cH:15][cH:16][cH:17][cH:18]4)[NH:14]3)[c:7]1=[O:8])[s:22][cH:23][cH:24]2>>[N:1]([n:2]1[c:3]2[c:4]([c:5]([OH:21])[c:6]([C:9]3=[N:10][S:11](=[O:19])(=[O:20])[c:12]4[c:13]([cH:15][cH:16][cH:17][cH:18]4)[NH:14]3)[c:7]1=[O:8])[s:22][cH:23][cH:24]2)=[CH:25][c:27]1[cH:28][c:29]([C:30]#[N:31])[cH:32][cH:33][cH:34]1참가 물질
4
반응물 3
생성물 1
출처 및 근거
- ORD 기록
- ord-dccd5989b288499992168b4cf728d3f2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)