HRID1141775

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID7369

Benzenesulfonyl chloride

C6H5ClO2S

HCID8471

Triethylamine

C6H15N

结构：Nc1cc2c(cc1Cl)N1CCCC(NC(=O)C(F)(F)F)C1c1ccccc1O2

HCID87537078

未命名化合物

PRODUCTS

生成物

结构：O=C(NC1CCCN2c3cc(Cl)c(NS(=O)(=O)c4ccccc4)cc3Oc3ccccc3C12)C(F)(F)F

HCID87537341

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-de62a1062efc471b815b16ac48d30ca3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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