HRID676036

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

Dimethylformamide

C3H7NO

HCID566324

1-(1-Methyl-4-piperidinyl)piperazine

C10H21N3

反应SMILES：CN1CCN=C1c1ccc(NC(=O)C(NC(=O)Nc2ccc(Cl)cc2)c2ccccc2Br)cc1

HCID11692377

未命名化合物

PRODUCTS

产物

反应SMILES：CN1CCC(N2CCN(NC(=O)C(NC(=O)Nc3ccc(Cl)cc3)c3ccccc3Br)CC2)CC1

HCID11649811

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-293257aa4766456a8e73cd9e2e3d8bc0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

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