HRID210809

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID7693

4-Chlorophenyl isocyanate

C7H4ClNO

HCID67095372

未命名化合物

PRODUCTS

产物

HCID75630606

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-ae6033361d2c41d18cea13a1dc10fbeb
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

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