HRID819285

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID13405

p-Toluoyl chloride

C8H7ClO

反应SMILES：CC(C)(C)OC(=O)NCCCNC(c1nn2ccc(Cl)c2c(=O)n1Cc1ccccc1)C1CC1

HCID69591847

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1ccc(C(=O)N(CCCNC(=O)OC(C)(C)C)C(c2nn3ccc(Cl)c3c(=O)n2Cc2ccccc2)C2CC2)cc1

HCID69591850

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-b96c00a06fcf436b9f0fa1602fa5623f
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应SMILES

[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13]([NH:14][CH2:15][CH2:16][CH2:17][NH:18][CH:19]([CH:20]1[CH2:21][CH2:22]1)[c:23]1[n:24][n:25]2[c:26]([c:27](=[O:36])[n:28]1[CH2:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[c:37]([Cl:40])[cH:38][cH:39]2)=[O:41].[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:42][c:43]1[cH:44][cH:45][c:46]([C:47](=[O:48])[Cl:49])[cH:50][cH:51]1.[Cl:52][CH2:53][Cl:54]>>[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13]([NH:14][CH2:15][CH2:16][CH2:17][N:18]([CH:19]([CH:20]1[CH2:21][CH2:22]1)[c:23]1[n:24][n:25]2[c:26]([c:27](=[O:36])[n:28]1[CH2:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[c:37]([Cl:40])[cH:38][cH:39]2)[C:47]([c:46]1[cH:45][cH:44][c:43]([CH3:42])[cH:51][cH:50]1)=[O:48])=[O:41]