HRID1545413

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID308449

5-(Chlorosulfonyl)-2-methylbenzoic acid

C8H7ClO4S

结构：NCc1cccc(CN(Cc2ccc(-c3ccccc3)cc2)S(=O)(=O)c2cc(Cl)cc(Cl)c2O)c1

HCID58531388

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(S(=O)(=O)NCc2cccc(CN(Cc3ccc(-c4ccccc4)cc3)S(=O)(=O)c3cc(Cl)cc(Cl)c3O)c2)cc1C(=O)O

HCID66616505

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-521c6cb027b74ee684cd260b0723522b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[Cl:43][S:44](=[O:45])(=[O:46])[c:47]1[cH:48][cH:49][c:50]([CH3:56])[c:51]([C:52](=[O:53])[OH:54])[cH:55]1.[Cl:57][CH2:58][Cl:59].[NH2:1][CH2:2][c:3]1[cH:4][c:5]([CH2:6][N:7]([S:8](=[O:9])(=[O:10])[c:11]2[c:12]([OH:19])[c:13]([Cl:18])[cH:14][c:15]([Cl:17])[cH:16]2)[CH2:20][c:21]2[cH:22][cH:23][c:24](-[c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[cH:25][cH:26]2)[cH:33][cH:34][cH:35]1>>[NH:1]([CH2:2][c:3]1[cH:4][c:5]([CH2:6][N:7]([S:8](=[O:9])(=[O:10])[c:11]2[c:12]([OH:19])[c:13]([Cl:18])[cH:14][c:15]([Cl:17])[cH:16]2)[CH2:20][c:21]2[cH:22][cH:23][c:24](-[c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[cH:25][cH:26]2)[cH:33][cH:34][cH:35]1)[S:44](=[O:45])(=[O:46])[c:47]1[cH:48][cH:49][c:50]([CH3:56])[c:51]([C:52](=[O:53])[OH:54])[cH:55]1