HRID137046

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7412

Benzoyl chloride

C7H5ClO

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID81531

Diisopropylethylamine

C8H19N

结构：COC(=O)c1ccc2c(c1)c(Cc1ccc(N)cc1)cn2C

HCID69447499

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc2c(c1)c(Cc1ccc(NC(=O)c3ccccc3)cc1)cn2C

HCID69453037

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8472f7a268ed4e27b21da4e3305a4d11
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

[C:32]([c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)(=[O:39])[Cl:40].[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[c:8]([CH2:15][c:16]3[cH:17][cH:18][c:19]([NH2:22])[cH:20][cH:21]3)[cH:9][n:10]([CH3:14])[c:11]2[cH:12][cH:13]1.[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[CH:23]([N:24]([CH2:25][CH3:26])[CH:27]([CH3:28])[CH3:29])([CH3:30])[CH3:31]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[c:8]([CH2:15][c:16]3[cH:17][cH:18][c:19]([NH:22][C:32]([c:33]4[cH:34][cH:35][cH:36][cH:37][cH:38]4)=[O:39])[cH:20][cH:21]3)[cH:9][n:10]([CH3:14])[c:11]2[cH:12][cH:13]1