HRID678771

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID6365

1,1-Dichloroethane

C2H4Cl2

HCID7377

Benzenesulfonamide, 3-amino-

C6H8N2O2S

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID23282848

1-(tert-Butoxycarbonyl)-4-methylpiperidine-4-carboxylic acid

C12H21NO4

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(C)(C(=O)Nc2cccc(S(N)(=O)=O)c2)CC1

HCID67036917

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-af991d38a1ed4b48b948d549a23ac936
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[OH:16])([CH3:17])[CH2:12][CH2:13]1.[Cl:24][C:25]([C:26]([Cl:27])=[O:28])=[O:29].[Cl:41][CH:42]([Cl:43])[CH3:44].[Cl:45][CH2:46][Cl:47].[NH2:30][c:31]1[cH:32][c:33]([S:37](=[O:38])(=[O:39])[NH2:40])[cH:34][cH:35][cH:36]1.[O:48]=[CH:49][N:50]([CH3:51])[CH3:52].[cH:18]1[cH:19][cH:20][n:21][cH:22][cH:23]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:16])[NH:30][c:31]2[cH:32][c:33]([S:37](=[O:38])(=[O:39])[NH2:40])[cH:34][cH:35][cH:36]2)([CH3:17])[CH2:12][CH2:13]1