HRID104926

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID6228

Dimethylformamide

C3H7NO

HCID7498

alpha-Bromotoluene

C7H7Br

HCID166653

Hydride

H-

反应SMILES：Cc1cc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c(Br)cc1Cl

HCID71127758

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1cc(N(Cc2ccccc2)C(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c(Br)cc1Cl

HCID69265940

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-91dfa1392b9b4da385ceb954d32f22ee
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

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