HRID2339511

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID961

Hydroxide

HO-

HCID6228

Dimethylformamide

C3H7NO

HCID7971

3-Pyridinol

C5H5NO

HCID166653

Hydride

H-

反应SMILES：COC(=O)C(CCSC)NC(=O)c1ccc(CBr)cc1-c1ccccc1

HCID23436051

未命名化合物

PRODUCTS

产物

反应SMILES：COC(=O)C(CCSC)NC(=O)c1ccc(COc2cccnc2)cc1-c1ccccc1

HCID23436175

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-8ca1c617d2004bb29f8fce6fcc5174e2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应SMILES

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