HRID824108

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID8857

Ethyl acetate

C4H8O2

HCID16028

Tetrabutylammonium

C16H36N+

HCID19660

Carbonate

CO3-2

HCID30165

Iodide ion

I-

HCID31275

1,4-Dioxane

C4H8O2

HCID5018790

4-[2-(trifluoromethyl)phenoxy]piperidine

C12H14F3NO

HCID65561565

6-Chloro-N-(2-cyclopropylethyl)pyridazine-3-carboxamide

C10H12ClN3O

PRODUCTS

生成物

结构：O=C(NCCC1CC1)c1ccc(N2CCC(Oc3ccccc3C(F)(F)F)CC2)nn1

HCID11590143

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-65b18f28caf84be392a8e95a3c930470
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:33](=[O:34])([O-:35])[O-:36].[CH2:40]([N+:41]([CH2:42][CH2:43][CH2:44][CH3:45])([CH2:46][CH2:47][CH2:48][CH3:49])[CH2:50][CH2:51][CH2:52][CH3:53])[CH2:54][CH2:55][CH3:56].[CH3:63][CH2:64][O:65][C:66]([CH3:67])=[O:68].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[NH:10][CH2:11][CH2:12][CH:13]2[CH2:14][CH2:15]2)[n:6][n:7]1.[F:16][C:17]([c:18]1[c:19]([O:20][CH:21]2[CH2:22][CH2:23][NH:24][CH2:25][CH2:26]2)[cH:27][cH:28][cH:29][cH:30]1)([F:31])[F:32].[I-:39].[K+:37].[K+:38].[O:57]1[CH2:58][CH2:59][O:60][CH2:61][CH2:62]1>>[c:2]1([N:24]2[CH2:23][CH2:22][CH:21]([O:20][c:19]3[c:18]([C:17]([F:16])([F:31])[F:32])[cH:30][cH:29][cH:28][cH:27]3)[CH2:26][CH2:25]2)[cH:3][cH:4][c:5]([C:8](=[O:9])[NH:10][CH2:11][CH2:12][CH:13]2[CH2:14][CH2:15]2)[n:6][n:7]1