HRID1564470

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID66824

4-Chlorobenzenesulphonamide

C6H6ClNO2S

HCID4241466

4-Pentylbicyclo[2.2.2]octane-1-carboxylic acid

C14H24O2

PRODUCTS

生成物

结构：CCCCCC12CCC(C(=O)NS(=O)(=O)c3ccc(Cl)cc3)(CC1)CC2

HCID68441773

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-33215cb1c48349238e3e925afb65c137
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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