HRID160184

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID74242

2,2,2-Trifluoroethanesulfonyl chloride

C2H2ClF3O2S

结构：NC(=O)c1cc(-c2ccccc2)cc2c(C3CCNCC3)n[nH]c12

HCID178513520

未命名化合物

PRODUCTS

生成物

结构：NC(=O)c1cc(-c2ccccc2)cc2c(C3CCN(S(=O)(=O)CC(F)(F)F)CC3)n[nH]c12

HCID178513533

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-02402c1faec742d4a890261add241ae0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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