HRID1206711

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID6344

Dichloromethane

CH2Cl2

HCID6371

Phosgene

CCl2O

反应SMILES：CC(C)(C)CC1CNC(c2cccc(Cl)c2)C12C(=O)Nc1cc(Cl)ccc12

HCID67337897

未命名化合物

PRODUCTS

产物

反应SMILES：CC(C)(C)CC1CN(C(=O)Cl)C(c2cccc(Cl)c2)C12C(=O)Nc1cc(Cl)ccc12

HCID76776160

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-bdab13045f81462981983a4e1a9074f5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应SMILES

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