HRID662135

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7412

Benzoyl chloride

C7H5ClO

HCID8028

Tetrahydrofuran

C4H8O

HCID81531

Diisopropylethylamine

C8H19N

HCID59667325

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1cncc2c(COc3cccc(NC(=O)c4ccccc4)c3)csc12

HCID24800096

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ce41eb5eaf7e43e38995a96c45a8a77c
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

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