HRID118522

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID11400

Ethyl 3-aminobenzoate

C9H11NO2

HCID178449982

未命名化合物

PRODUCTS

生成物

结构：CCCC(NS(=O)(=O)c1ccc(Cl)cc1)C(=S)Nc1cccc(C(=O)OCC)c1

HCID19032903

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d185ba159db640f9b0253020dba6eb46
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH:31]1([N:32]=[C:33]=[N:34][CH:35]2[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]2)[CH2:41][CH2:42][CH2:43][CH2:44][CH2:45]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH:12]([C:13](=[S:14])[OH:15])[CH2:16][CH2:17][CH3:18])[cH:6][cH:7]1.[Cl:46][CH2:47][Cl:48].[NH2:19][c:20]1[cH:21][c:22]([C:23](=[O:24])[O:25][CH2:26][CH3:27])[cH:28][cH:29][cH:30]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH:12]([C:13](=[S:14])[NH:19][c:20]2[cH:21][c:22]([C:23](=[O:24])[O:25][CH2:26][CH3:27])[cH:28][cH:29][cH:30]2)[CH2:16][CH2:17][CH3:18])[cH:6][cH:7]1