HRID2124498

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID80598

Benzenethiol, 2-bromo-

C6H5BrS

HCID166653

Hydride

H-

结构：O=S(=O)(C=CC(=Nc1ccccc1)Oc1ccccc1)c1ccccc1

HCID86617322

未命名化合物

PRODUCTS

生成物

HCID69127893

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-23d368169d344df79c1afa36700dc378
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br:8][c:9]1[c:10]([SH:15])[cH:11][cH:12][cH:13][cH:14]1.[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[H-:1].[Na+:2].[O:3]=[CH:4][N:5]([CH3:6])[CH3:7].[OH2:48].[c:16]1([N:22]=[C:23]([CH:24]=[CH:25][S:26]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)(=[O:33])=[O:34])[O:35][c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[cH:17][cH:18][cH:19][cH:20][cH:21]1>>[Br:8][c:9]1[c:10]([S:15][CH:25]=[CH:24][C:23](=[N:22][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[O:35][c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[cH:11][cH:12][cH:13][cH:14]1