HRID213409

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

结构：CN(C)NC(=O)C1(Cc2ccccc2)CCN(C(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)NC(=O)OC(C)(C)C)CC1

HCID69019306

未命名化合物

PRODUCTS

生成物

结构：CN(C)NC(=O)C1(Cc2ccccc2)CCN(C(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)CC1

HCID18365191

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2d269de33384459d99f73d9ec16c8f35
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:1]([O:2][C:3](=[O:4])[NH:7][C:8]([CH3:9])([CH3:10])[C:11]([NH:12][CH:13]([C:14](=[O:15])[N:16]1[CH2:17][CH2:18][C:19]([C:22](=[O:23])[NH:24][N:25]([CH3:26])[CH3:27])([CH2:28][c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[CH2:20][CH2:21]1)[CH2:35][c:36]1[cH:37][nH:38][c:39]2[cH:40][cH:41][cH:42][cH:43][c:44]12)=[O:45])([CH3:5])([CH3:6])[CH3:46].[CH2:54]([Cl:55])[Cl:56].[OH:47][C:48]([C:49]([F:50])([F:51])[F:52])=[O:53]>>[NH2:7][C:8]([CH3:9])([CH3:10])[C:11]([NH:12][CH:13]([C:14](=[O:15])[N:16]1[CH2:17][CH2:18][C:19]([C:22](=[O:23])[NH:24][N:25]([CH3:26])[CH3:27])([CH2:28][c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[CH2:20][CH2:21]1)[CH2:35][c:36]1[cH:37][nH:38][c:39]2[cH:40][cH:41][cH:42][cH:43][c:44]12)=[O:45]