HRID175681

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID7937

2,6-Dimethylpyridine

C7H9N

HCID61140

n-Butyl chloroformate

C5H9ClO2

结构：Cc1ccccc1S(=O)(=O)NC(=O)c1ccc2c(ccn2Cc2cccc(N)c2)c1

HCID19780416

未命名化合物

PRODUCTS

生成物

结构：CCCCOC(=O)Nc1cccc(Cn2ccc3cc(C(=O)NS(=O)(=O)c4ccccc4C)ccc32)c1

HCID19780412

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3a8ba68eed264039a8b5a336140eba0a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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