HRID1226997

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID81531

Diisopropylethylamine

C8H19N

HCID433804

3,6-Dichloropyridazine-4-carboxylic acid

C5H2Cl2N2O2

结构：CC(C)(C)OC(=O)NC1CNCC(NC(=O)OC(C)(C)C)C1

HCID21103706

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC1CC(NC(=O)OC(C)(C)C)CN(c2cc(C(=O)O)c(Cl)nn2)C1

HCID58865519

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-266c94a8c43a48999c8c31600c41e0dd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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