HRID97909

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID19049

Piperidine-1-propylamine

C8H18N2

HCID31374

Dimethylacetamide

C4H9NO

结构：CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1ccc(-c2ccnc(Cl)n2)cc1

HCID86599911

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1ccc(-c2ccnc(NCCCN3CCCCC3)n2)cc1

HCID68408293

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c5b92246c62c441ab9bcdd607d3796f4
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

[C:11]([CH3:12])([CH3:13])([CH3:14])[O:15][C:16](=[O:17])[NH:18][c:19]1[c:20]([NH:25][C:26]([c:27]2[cH:28][cH:29][c:30](-[c:33]3[n:34][c:35]([Cl:39])[n:36][cH:37][cH:38]3)[cH:31][cH:32]2)=[O:40])[cH:21][cH:22][cH:23][cH:24]1.[CH3:41][N:42]([CH3:43])[C:44](=[O:45])[CH3:46].[NH2:1][CH2:2][CH2:3][CH2:4][N:5]1[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]1>>[NH:1]([CH2:2][CH2:3][CH2:4][N:5]1[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]1)[c:35]1[n:34][c:33](-[c:30]2[cH:29][cH:28][c:27]([C:26]([NH:25][c:20]3[c:19]([NH:18][C:16]([O:15][C:11]([CH3:12])([CH3:13])[CH3:14])=[O:17])[cH:24][cH:23][cH:22][cH:21]3)=[O:40])[cH:32][cH:31]2)[cH:38][cH:37][n:36]1