HRID2125059

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID6371

Phosgene

CCl2O

HCID23505820

3-Amino-5-(1,1-dimethylethyl)-2-methoxy-N-methylbenzamide

C13H20N2O2

HCID23505862

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)c1cc(C(C)(C)C)cc(NC(=O)Nc2ccc(Oc3ccncc3)c3ccccc23)c1OC

HCID23505875

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-75d9a1f23801477e829d92a842272f75
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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