HRID134608

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)CC(C)N1C(=O)OC(C)(C)C

HCID72264472

未命名化合物

PRODUCTS

生成物

结构：CC1CN(Cc2ccc(NS(=O)(=O)c3ccc(Cl)nc3)cc2)CC(C)N1C(=O)OC(C)(C)C

HCID72318335

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9fd792b4723f4ede865971460224f53a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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