HRID318957

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

HCID66669974

未命名化合物

HCID86086993

2,6-Dichloro-3,5-dimethoxyphenyl isocyanate

C9H7Cl2NO3

PRODUCTS

产物

HCID57710293

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-ba76d767adf3427f98b1402136bd8e87
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应SMILES

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