HRID168865

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID10492228

未命名化合物

HCID18505275

未命名化合物

PRODUCTS

生成物

结构：CN(Cc1ccc2cc(O)ccc2c1)C(=O)c1cn(Cc2ccccc2)c2ccccc12

HCID86587387

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d3251a58245c40d5a5a44809fd43522a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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