HRID197582

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

Dimethylformamide

C3H7NO

HCID8100

1,5-Dibromopentane

C5H10Br2

HCID166653

Hydride

H-

反应SMILES：Cc1cc(C)c(S(=O)(=O)Nc2c3ccccc3nc3ccccc23)c(C)c1

HCID54507950

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1cc(C)c(S(=O)(=O)N(CCCCCBr)c2c3ccccc3nc3ccccc23)c(C)c1

HCID54190112

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-4f2556360ed54a3f8c8ef7fdb5bf675b
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

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