HRID282830

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID295763

2-methylpyrimidin-4-amine

C5H7N3

结构：CS(=O)(=O)c1ccc(C(CC2CCCC2)C(=O)O)cc1C#N

HCID12069499

未命名化合物

PRODUCTS

生成物

结构：Cc1nccc(NC(=O)C(CC2CCCC2)c2ccc(S(C)(=O)=O)c(C#N)c2)n1

HCID22315166

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8a558833d9044853948200e8c97930a4
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](#[N:2])[c:3]1[cH:4][c:5]([CH:13]([C:14](=[O:15])[OH:16])[CH2:17][CH:18]2[CH2:19][CH2:20][CH2:21][CH2:22]2)[cH:6][cH:7][c:8]1[S:9](=[O:10])(=[O:11])[CH3:12].[CH2:44]([Cl:45])[Cl:46].[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[Cl:23][C:24]([C:25]([Cl:26])=[O:27])=[O:28].[NH2:29][c:30]1[n:31][c:32]([CH3:36])[n:33][cH:34][cH:35]1>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([CH:13]([C:14](=[O:16])[NH:29][c:30]2[n:31][c:32]([CH3:36])[n:33][cH:34][cH:35]2)[CH2:17][CH:18]2[CH2:19][CH2:20][CH2:21][CH2:22]2)[cH:6][cH:7][c:8]1[S:9](=[O:10])(=[O:11])[CH3:12]