HRID208701

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID3017130

4-Phenyl-4-piperidinecarboxamide

C12H16N2O

结构：O=C(c1ccccc1)N1CCC(CCCS(=O)(=O)[O-])(c2ccc(Cl)c(Cl)c2)C1

HCID86750907

未命名化合物

PRODUCTS

生成物

结构：NC(=O)C1(c2ccccc2)CCN(CCC2(c3ccc(Cl)c(Cl)c3)CCN(C(=O)c3ccccc3)C2)CC1

HCID44212285

1-[2-[1-Benzoyl-3-(3,4-dichlorophenyl)-3-pyrrolidinyl]ethyl]-4-phenyl-4-piperidinecarboxamide

C31H33Cl2N3O2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3969e0f6923147b9bb703389c68a7cb8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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