HRID2146985

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID2792792

6-Chloropyridine-3-sulfonyl chloride

C5H3Cl2NO2S

结构：CC1CN(Cc2ccc(N)cc2)CCN1C(=O)OC(C)(C)C

HCID72264407

未命名化合物

PRODUCTS

生成物

结构：CC1CN(Cc2ccc(NS(=O)(=O)c3ccc(Cl)nc3)cc2)CCN1C(=O)OC(C)(C)C

HCID178430378

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-02b5a501f3094c5781d72df4f214d782
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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