HRID96349

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID737259

未命名化合物

HCID11066000

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1)c1ccccc1-c1ccc(C(F)(F)F)cc1

HCID22499401

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-89939978fb3b45068eaf5e845d77c3d8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[Cl:40][CH2:41][Cl:42].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[c:10]([C:15](=[O:16])[Cl:17])[cH:11][cH:12][cH:13][cH:14]2)[cH:7][cH:8]1)([F:18])[F:19].[c:20]1([CH2:26][N:27]2[CH2:28][CH2:29][N:30]([c:33]3[cH:34][cH:35][c:36]([NH2:39])[cH:37][cH:38]3)[CH2:31][CH2:32]2)[cH:21][cH:22][cH:23][cH:24][cH:25]1>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[c:10]([C:15](=[O:16])[NH:39][c:36]3[cH:35][cH:34][c:33]([N:30]4[CH2:29][CH2:28][N:27]([CH2:26][c:20]5[cH:21][cH:22][cH:23][cH:24][cH:25]5)[CH2:32][CH2:31]4)[cH:38][cH:37]3)[cH:11][cH:12][cH:13][cH:14]2)[cH:7][cH:8]1)([F:18])[F:19]