HRID681279

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID11377

7-Aminoquinoline

C9H8N2

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID2777788

1-[5-(Trifluoromethyl)pyridin-2-yl]piperidine-4-carboxylic acid

C12H13F3N2O2

PRODUCTS

生成物

结构：O=C(Nc1ccc2cccnc2c1)C1CCN(c2ccc(C(F)(F)F)cn2)CC1

HCID57682695

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ca0f933d97104db6a0ec87f206a2b567
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[Cl:20][C:21]([C:22]([Cl:23])=[O:24])=[O:25].[Cl:44][CH2:45][CH2:46][Cl:47].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([N:9]2[CH2:10][CH2:11][CH:12]([C:15](=[O:16])[OH:17])[CH2:13][CH2:14]2)[n:7][cH:8]1)([F:18])[F:19].[NH2:33][c:34]1[cH:35][cH:36][c:37]2[cH:38][cH:39][cH:40][n:41][c:42]2[cH:43]1.[O:48]=[CH:49][N:50]([CH3:51])[CH3:52]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([N:9]2[CH2:10][CH2:11][CH:12]([C:15](=[O:17])[NH:33][c:34]3[cH:35][cH:36][c:37]4[cH:38][cH:39][cH:40][n:41][c:42]4[cH:43]3)[CH2:13][CH2:14]2)[n:7][cH:8]1)([F:18])[F:19]