HRID109897

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID7397

p-Toluenesulfonyl chloride

C7H7ClO2S

HCID8471

Triethylamine

C6H15N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID17984339

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(S(=O)(=O)OCCc2nc(-c3ccc(N(C)c4ccccc4)cc3)oc2C)cc1

HCID58978958

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2efaed45c4f74883831786ee3510b96d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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