HRID169883

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID30165

Iodide ion

I-

HCID221144

Chloromethyl propanoate

C4H7ClO2

HCID178514690

未命名化合物

PRODUCTS

产物

HCID60208422

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-930479a677c64d5082fd67823bf971b7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

[C:24]([CH2:25][CH3:26])(=[O:27])[O:28][CH2:29][Cl:30].[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[I-:39].[NH2:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][c:7](-[c:19]2[n:20][n:21][n:22][nH:23]2)[c:8]([NH:9][CH2:10][c:11]2[cH:12][cH:13][cH:14][s:15]2)[cH:16][c:17]1[Cl:18].[Na+:38].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44]>>[NH2:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][c:7](-[c:19]2[n:20]([CH2:29][O:28][C:24]([CH2:25][CH3:26])=[O:27])[n:21][n:22][n:23]2)[c:8]([NH:9][CH2:10][c:11]2[cH:12][cH:13][cH:14][s:15]2)[cH:16][c:17]1[Cl:18]