HRID818350

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID12176

Glycine ethyl ester

C4H9NO2

HCID81531

Diisopropylethylamine

C8H19N

结构：COc1nc(NCCc2ccc(Cl)cc2Cl)cc(-c2cccc(C(=O)O)c2)n1

HCID53320527

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CNC(=O)c1cccc(-c2cc(NCCc3ccc(Cl)cc3Cl)nc(OC)n2)c1

HCID11706060

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7990716798bc487aaf6456adae93073d
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

[CH2:39]([CH3:40])[O:41][C:42]([CH2:43][NH2:44])=[O:45].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[CH:29]([N:30]([CH:31]([CH3:32])[CH3:33])[CH2:34][CH3:35])([CH3:36])[CH3:37].[Cl:1][c:2]1[c:3]([CH2:9][CH2:10][NH:11][c:12]2[cH:13][c:14](-[c:20]3[cH:21][c:22]([C:23](=[O:24])[OH:25])[cH:26][cH:27][cH:28]3)[n:15][c:16]([O:18][CH3:19])[n:17]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[ClH:38].[OH2:46]>>[Cl:1][c:2]1[c:3]([CH2:9][CH2:10][NH:11][c:12]2[cH:13][c:14](-[c:20]3[cH:21][c:22]([C:23](=[O:24])[NH:44][CH2:43][C:42]([O:41][CH2:39][CH3:40])=[O:45])[cH:26][cH:27][cH:28]3)[n:15][c:16]([O:18][CH3:19])[n:17]2)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1