HRID810530

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID887

Methanol

CH4O

HCID6344

Dichloromethane

CH2Cl2

HCID256849

n-(3-formylphenyl)acetamide

C9H9NO2

反应SMILES：Cc1cc(C#N)cc(C)c1Oc1nc(NC2CCNCC2)ncc1Br

HCID67339367

未命名化合物

PRODUCTS

产物

反应SMILES：CC(=O)Nc1cccc(CN2CCC(Nc3ncc(Br)c(Oc4c(C)cc(C#N)cc4C)n3)CC2)c1

HCID24959496

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-5ec7bcd54dcd4014b876d4b9404d99ce
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应SMILES

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