HRID685120

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID81531

Diisopropylethylamine

C8H19N

HCID22114253

(Cyclobutyloxy)acetic acid

C6H10O3

HCID67140767

未命名化合物

PRODUCTS

生成物

结构：N#Cc1ccc2oc(-c3ccc(NC(=O)COC4CCC4)cc3)nc2c1

HCID24738196

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-04682b934efd46b48f0147672a7a9cf3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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