HRID940070

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

HCID81531

Diisopropylethylamine

C8H19N

结构：NS(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID2783165

3,5-bis(trifluoromethyl)benzenesulfonamide

C8H5F6NO2S

结构：NC(=O)c1ccc(C(F)(F)F)cc1N1CCC(CC(=O)O)CC1

HCID68442763

未命名化合物

PRODUCTS

生成物

结构：NC(=O)c1ccc(C(F)(F)F)cc1N1CCC(CC(=O)NS(=O)(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1

HCID86597097

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e16736dd9e334d92b294dabd925a6f08
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

[C:5]([NH2:6])(=[O:7])[c:8]1[c:9]([N:18]2[CH2:19][CH2:20][CH:21]([CH2:24][C:25](=[O:26])[OH:27])[CH2:22][CH2:23]2)[cH:10][c:11]([C:14]([F:15])([F:16])[F:17])[cH:12][cH:13]1.[CH2:1]([Cl:2])[CH2:3][Cl:4].[CH3:55][N:56]([c:57]1[cH:58][cH:59][n:60][cH:61][cH:62]1)[CH3:63].[CH:46]([N:47]([CH2:48][CH3:49])[CH:50]([CH3:51])[CH3:52])([CH3:53])[CH3:54].[F:28][C:29]([c:30]1[cH:31][c:32]([S:40](=[O:41])(=[O:42])[NH2:43])[cH:33][c:34]([C:36]([F:37])([F:38])[F:39])[cH:35]1)([F:44])[F:45].[O:64]=[CH:65][N:66]([CH3:67])[CH3:68]>>[C:5]([NH2:6])(=[O:7])[c:8]1[c:9]([N:18]2[CH2:19][CH2:20][CH:21]([CH2:24][C:25](=[O:26])[NH:43][S:40]([c:32]3[cH:31][c:30]([C:29]([F:28])([F:44])[F:45])[cH:35][c:34]([C:36]([F:37])([F:38])[F:39])[cH:33]3)(=[O:41])=[O:42])[CH2:22][CH2:23]2)[cH:10][c:11]([C:14]([F:15])([F:16])[F:17])[cH:12][cH:13]1