HRID1144350

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6547

Azobisisobutyronitrile

C8H12N4

HCID8003

Pentane

C5H12

HCID67184

1-Bromopyrrolidine-2,5-dione

C4H4BrNO2

结构：COC(=O)c1c(C)n(S(=O)(=O)c2ccccc2)c2ncc(Br)cc12

HCID58266564

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1c(CBr)n(S(=O)(=O)c2ccccc2)c2ncc(Br)cc12

HCID58266377

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8227fce489b142d3833422639842c291
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

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