HRID2310060

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID64801

Benzenepropanoyl chloride

C9H9ClO

HCID81531

Diisopropylethylamine

C8H19N

反应SMILES：Nc1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1

HCID66905728

未命名化合物

PRODUCTS

产物

反应SMILES：O=C(CCc1ccccc1)Nc1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1

HCID11488539

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-281155b2ca384e4799eba3a49698e543
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

[C:1]([CH2:2][CH2:3][c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)(=[O:10])[Cl:11].[CH:40]([N:41]([CH:42]([CH3:43])[CH3:44])[CH2:45][CH3:46])([CH3:47])[CH3:48].[Cl:37][CH2:38][Cl:39].[NH2:12][c:13]1[cH:14][cH:15][c:16]([N:19]2[CH2:20][CH2:21][N:22]([C:25](=[O:26])[c:27]3[c:28]([C:33]([F:34])([F:35])[F:36])[cH:29][cH:30][cH:31][cH:32]3)[CH2:23][CH2:24]2)[n:17][cH:18]1>>[C:1]([CH2:2][CH2:3][c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)(=[O:10])[NH:12][c:13]1[cH:14][cH:15][c:16]([N:19]2[CH2:20][CH2:21][N:22]([C:25](=[O:26])[c:27]3[c:28]([C:33]([F:34])([F:35])[F:36])[cH:29][cH:30][cH:31][cH:32]3)[CH2:23][CH2:24]2)[n:17][cH:18]1