HRID89873

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9588

Benzenesulfonyl chloride, 4-fluoro-

C6H4ClFO2S

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

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)c4ccc(F)cc4)CC3)n[nH]c12

HCID178513523

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-410fc84d354b461dad42f53ec2a28065
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:37][N:38]([c:39]1[cH:40][cH:41][n:42][cH:43][cH:44]1)[CH3:45].[ClH:1].[F:26][c:27]1[cH:28][cH:29][c:30]([S:33](=[O:34])(=[O:35])[Cl:36])[cH:31][cH:32]1.[O:46]=[CH:47][N:48]([CH3:49])[CH3:50].[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:33]([c:30]5[cH:29][cH:28][c:27]([F:26])[cH:32][cH:31]5)(=[O:34])=[O:35])[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