HRID2341286

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID8764

Benzenamine, 4-phenoxy-

C12H11NO

HCID20791627

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1cn2ncc(C#N)c(Nc3ccc(Oc4ccccc4)cc3)c2c1CO

HCID20791601

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4f22cde01ca74c16b5f01f188decc251
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

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