HRID800197

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID6212

Chloroform

CHCl3

HCID6344

Dichloromethane

CH2Cl2

HCID101856

3,5-Bis(trifluoromethyl)benzoyl chloride

C9H3ClF6O

HCID18426155

2-Amino-N-[[1-[(4-chlorophenyl)methyl]-4-piperidinyl]methyl]acetamide

C15H22ClN3O

PRODUCTS

生成物

结构：O=C(CNC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC1CCN(Cc2ccc(Cl)cc2)CC1

HCID18426201

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-517267b5b4b14cc3abf80fb1033352f3
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

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