HRID669408

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID81531

Diisopropylethylamine

C8H19N

HCID2778223

4-(Difluoromethoxy)benzenesulfonyl chloride

C7H5ClF2O3S

HCID62672949

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(OC(F)F)cc3)CC2C)cn1

HCID72234645

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-72fed7dc2f414d47a50e2fdde7f0d73b
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

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