HRID2131521

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1485

Benzenemethanamine, 2,4-dichloro-

C7H7Cl2N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID59448221

未命名化合物

PRODUCTS

生成物

结构：CNc1nc(C)nc(NC2CCCC(C(=O)NCc3ccc(Cl)cc3Cl)C2)n1

HCID67493614

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7843e14db6244299a85567ebc552bfbd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH3:1][c:2]1[n:3][c:4]([NH:10][CH:11]2[CH2:12][CH:13]([C:17](=[O:18])[OH:19])[CH2:14][CH2:15][CH2:16]2)[n:5][c:6]([NH:8][CH3:9])[n:7]1.[CH3:30][CH2:31][N:32]=[C:33]=[N:34][CH2:35][CH2:36][CH2:37][N:38]([CH3:39])[CH3:40].[CH3:41][N:42]([c:43]1[cH:44][cH:45][n:46][cH:47][cH:48]1)[CH3:49].[Cl:20][c:21]1[c:22]([CH2:28][NH2:29])[cH:23][cH:24][c:25]([Cl:27])[cH:26]1>>[CH3:1][c:2]1[n:3][c:4]([NH:10][CH:11]2[CH2:12][CH:13]([C:17](=[O:19])[NH:29][CH2:28][c:22]3[c:21]([Cl:20])[cH:26][c:25]([Cl:27])[cH:24][cH:23]3)[CH2:14][CH2:15][CH2:16]2)[n:5][c:6]([NH:8][CH3:9])[n:7]1