HRID820337

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID313

Hydrochloric Acid

ClH

HCID679

Dimethyl sulfoxide

C2H6OS

HCID813

Potassium cation

K+

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID31968

N-benzyl-2-chloro-N-methylethanamine

C10H14ClN

结构：CC(C)(C)OC(=O)N1CCC(c2nc(-c3ccc(F)c(Cl)c3)c[nH]2)CC1

HCID178451793

未命名化合物

PRODUCTS

生成物

结构：CN(CCn1cc(-c2ccc(F)c(Cl)c2)nc1C1CCN(C(=O)OC(C)(C)C)CC1)Cc1ccccc1

HCID67264856

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8cc9e94dd7654146a5128930df9cc00e
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:3]([CH3:4])([CH3:5])([CH3:6])[O:7][C:8](=[O:9])[N:10]1[CH2:11][CH2:12][CH:13]([c:16]2[nH:17][cH:18][c:19](-[c:21]3[cH:22][c:23]([Cl:28])[c:24]([F:27])[cH:25][cH:26]3)[n:20]2)[CH2:14][CH2:15]1.[CH2:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[N:41]([CH3:42])[CH2:43][CH2:44][Cl:45].[CH3:29][S:30]([CH3:31])=[O:32].[Cl-:50].[Cl:46][CH2:47][Cl:48].[ClH:33].[K+:2].[Na+:51].[OH-:1].[OH2:49]>>[C:3]([CH3:4])([CH3:5])([CH3:6])[O:7][C:8](=[O:9])[N:10]1[CH2:11][CH2:12][CH:13]([c:16]2[n:17]([CH2:44][CH2:43][N:41]([CH2:34][c:35]3[cH:36][cH:37][cH:38][cH:39][cH:40]3)[CH3:42])[cH:18][c:19](-[c:21]3[cH:22][c:23]([Cl:28])[c:24]([F:27])[cH:25][cH:26]3)[n:20]2)[CH2:14][CH2:15]1