HRID1210692

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID20767863

6-Hydroxy-N,2-dimethyl-1-benzothiophene-3-carboxamide

C11H11NO2S

HCID22143516

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)c1c(C)sc2cc(Oc3ccnc4cc(COCCN5CCCC5)sc34)ccc12

HCID20767891

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b8544755702c4ed88873d9413c45a9c3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:35](=[O:36])([O-:37])[O-:38].[CH3:20][NH:21][C:22](=[O:23])[c:24]1[c:25]2[c:26]([s:27][c:28]1[CH3:29])[cH:30][c:31]([OH:34])[cH:32][cH:33]2.[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][cH:7]1)[cH:8][c:9]([CH2:11][O:12][CH2:13][CH2:14][N:15]1[CH2:16][CH2:17][CH2:18][CH2:19]1)[s:10]2.[Cs+:39].[Cs+:40]>>[c:2]1([O:34][c:31]2[cH:30][c:26]3[c:25]([c:24]([C:22]([NH:21][CH3:20])=[O:23])[c:28]([CH3:29])[s:27]3)[cH:33][cH:32]2)[c:3]2[c:4]([n:5][cH:6][cH:7]1)[cH:8][c:9]([CH2:11][O:12][CH2:13][CH2:14][N:15]1[CH2:16][CH2:17][CH2:18][CH2:19]1)[s:10]2