HRID951831

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID80172

4-Cyanobenzoyl chloride

C8H4ClNO

结构：CC1=C(CCCCCN2CCNCC2)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C1=O

HCID22562427

未命名化合物

PRODUCTS

生成物

结构：CC1=C(CCCCCN2CCN(C(=O)c3ccc(C#N)cc3)CC2)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C1=O

HCID10175095

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c208ba9f86c74543b1b3fcf0c43e8ed2
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:8](#[N:9])[c:10]1[cH:11][cH:12][c:13]([C:14](=[O:15])[Cl:16])[cH:17][cH:18]1.[CH3:19][C:20]1=[C:24]([CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][N:30]2[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]2)[C:23](=[O:36])[N:22]([c:37]2[cH:38][c:39]([C:45]([F:46])([F:47])[F:48])[c:40]([C:41]#[N:42])[cH:43][cH:44]2)[C:21]1=[O:49].[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1>>[C:8](#[N:9])[c:10]1[cH:11][cH:12][c:13]([C:14](=[O:15])[N:33]2[CH2:32][CH2:31][N:30]([CH2:29][CH2:28][CH2:27][CH2:26][CH2:25][C:24]3=[C:20]([CH3:19])[C:21](=[O:49])[N:22]([c:37]4[cH:38][c:39]([C:45]([F:46])([F:47])[F:48])[c:40]([C:41]#[N:42])[cH:43][cH:44]4)[C:23]3=[O:36])[CH2:35][CH2:34]2)[cH:17][cH:18]1