HRID2330523

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID11983909

2-METHOXY-5-TRIFLUOROMETHYLPHENYL ISOCYANATE

C9H6F3NO2

HCID57974724

未命名化合物

PRODUCTS

产物

反应SMILES：COc1ccc(C(F)(F)F)cc1NC(=O)Nc1cccc(Cn2ccnc2-c2ccncc2)c1

HCID11626882

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-6a89dc3e37bf452cb67987f19832fc24
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应SMILES

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