HRID1543789

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID12543

Benzenesulfonamide, N,4-dimethyl-

C8H11NO2S

HCID105144

Palladium(2+)

Pd+2

HCID4574913

未命名化合物

HCID51354312

未命名化合物

PRODUCTS

生成物

结构：CC(=O)Nc1nc2ccc(-c3ccnc(N(C)S(=O)(=O)c4ccc(C)cc4)c3)cc2s1

HCID57585098

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4f8f138e76d046789105687f9d833c84
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH3:13][C:14]([CH3:15])([O-:16])[CH3:17].[CH3:1][NH:2][S:3](=[O:4])(=[O:5])[c:6]1[cH:7][cH:8][c:9]([CH3:12])[cH:10][cH:11]1.[Cl:19][c:20]1[n:21][cH:22][cH:23][c:24](-[c:26]2[cH:27][c:28]3[c:29]([n:30][c:31]([NH:33][C:34]([CH3:35])=[O:36])[s:32]3)[cH:37][cH:38]2)[cH:25]1.[Na+:18].[O-:45][C:46]([CH3:47])=[O:48].[O-:49][C:50]([CH3:51])=[O:52].[O:39]=[CH:40][N:41]([CH3:42])[CH3:43].[Pd+2:44]>>[CH3:1][N:2]([S:3](=[O:4])(=[O:5])[c:6]1[cH:7][cH:8][c:9]([CH3:12])[cH:10][cH:11]1)[c:20]1[n:21][cH:22][cH:23][c:24](-[c:26]2[cH:27][c:28]3[c:29]([n:30][c:31]([NH:33][C:34]([CH3:35])=[O:36])[s:32]3)[cH:37][cH:38]2)[cH:25]1