HRID96642

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID1140

Toluene

C7H8

HCID7498

alpha-Bromotoluene

C7H7Br

HCID19660

Carbonate

CO3-2

HCID30165

Iodide ion

I-

HCID31347

Sulfolane

C4H8O2S

结构：CCC1(C)CC(NC(=O)c2ccccc2)C(C)C(C)(CC)N1

HCID22486017

N-(2,6-Diethyl-2,3,6-trimethylpiperidin-4-yl)benzamide

C19H30N2O

PRODUCTS

生成物

结构：CCC1(C)CC(NC(=O)c2ccccc2)C(C)C(C)(CC)N1Cc1ccccc1

HCID20348330

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d1c1b1da6ae24ed9adeb7529542f807e
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

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