HRID957132

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID7412

Benzoyl chloride

C7H5ClO

结构：COC(=O)N1CC(c2c[nH]c3cc(F)ccc23)C2C1CCN2C(=O)C(NC(=O)OC(C)(C)C)C1CCCCC1

HCID67409757

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC(C(=O)N1CCC2C1C(c1c[nH]c3cc(F)ccc13)CN2C(=O)c1ccccc1)C1CCCCC1

HCID67408824

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9b82ebc041dc4481ab8d583f145e1964
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:40]([c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1)([Cl:47])=[O:48].[CH3:1][O:2][C:3](=[O:4])[N:5]1[CH:6]2[CH:7]([CH:8]([c:10]3[cH:11][nH:12][c:13]4[cH:14][c:15]([F:19])[cH:16][cH:17][c:18]34)[CH2:9]1)[N:20]([C:23]([CH:24]([CH:25]1[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]1)[NH:31][C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])=[O:39])[CH2:21][CH2:22]2.[Cl:49][CH2:50][Cl:51]>>[O:2]=[C:3]([N:5]1[CH:6]2[CH:7]([CH:8]([c:10]3[cH:11][nH:12][c:13]4[cH:14][c:15]([F:19])[cH:16][cH:17][c:18]34)[CH2:9]1)[N:20]([C:23]([CH:24]([CH:25]1[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]1)[NH:31][C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])=[O:39])[CH2:21][CH2:22]2)[c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1