HRID2325255

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8861

2,6-Diaminopyridine

C5H7N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

结构：COC(=O)CC1C(=O)N(C)Cc2cc(C(=O)O)ccc2N1C(C)=O

HCID86758535

未命名化合物

PRODUCTS

生成物

结构：COC(=O)CC1C(=O)N(C)Cc2cc(C(=O)Nc3cccc(N)n3)ccc2N1C(C)=O

HCID57102414

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3f750975979248e58903dd1c9e2de5ca
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

[C:16]([CH3:17])(=[O:18])[N:19]1[CH:20]([CH2:35][C:36](=[O:37])[O:38][CH3:39])[C:21](=[O:34])[N:22]([CH3:33])[CH2:23][c:24]2[c:25]1[cH:26][cH:27][c:28]([C:30](=[O:31])[OH:32])[cH:29]2.[CH2:12]([Cl:13])[CH2:14][Cl:15].[NH2:40][c:41]1[n:42][c:43]([NH2:47])[cH:44][cH:45][cH:46]1.[O:48]=[CH:49][N:50]([CH3:51])[CH3:52].[OH2:11].[OH:1][n:2]1[c:3]2[c:4]([cH:5][cH:6][cH:7][cH:8]2)[n:9][n:10]1>>[C:16]([CH3:17])(=[O:18])[N:19]1[CH:20]([CH2:35][C:36](=[O:37])[O:38][CH3:39])[C:21](=[O:34])[N:22]([CH3:33])[CH2:23][c:24]2[c:25]1[cH:26][cH:27][c:28]([C:30](=[O:31])[NH:40][c:41]1[n:42][c:43]([NH2:47])[cH:44][cH:45][cH:46]1)[cH:29]2