HRID932821

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID415294

1-(Ethanesulfonyl)piperazine

C6H14N2O2S

反应SMILES：CCOc1cc(C(C)(C)C#N)c(Cl)cc1C1=NC(c2ccc(Cl)cc2)C(c2ccc(Cl)cc2)N1C(=O)Cl

HCID87753332

未命名化合物

PRODUCTS

产物

反应SMILES：CCOc1cc(C(C)(C)C#N)c(Cl)cc1C1=NC(c2ccc(Cl)cc2)C(c2ccc(Cl)cc2)N1C(=O)N1CCN(S(=O)(=O)CC)CC1

HCID178466525

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-a785dc379e84432d911c5c11b0b6529d
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应SMILES

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