HRID297345

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7141919

6-Chloro-1-benzothiophene-2-carboxylic acid

C9H5ClO2S

HCID69309645

未命名化合物

PRODUCTS

产物

HCID69310562

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-033c35b871e04cdf9443c09f49a7ef72
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应SMILES

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