HRID2321440

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID15908

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

C8H17N3

HCID7019419

(1-methyl-1H-pyrazol-3-yl)methanamine

C5H9N3

HCID67359013

未命名化合物

PRODUCTS

生成物

结构：Cn1ccc(CNC(=O)CN2CCC(c3ccccc3)(c3ccccc3)C2=O)n1

HCID45275490

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-44f6598719fa4469b684f909731294e7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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