HRID2333980

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9033

Ethyleneimine

C2H5N

HCID96502

3-Phenylindole

C14H11N

HCID166653

Hydride

H-

结构：Cc1cc(C)c(S(=O)(=O)N2CC2C(F)(F)F)c(C)c1

HCID57474036

未命名化合物

HCID178418361

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C)c(S(=O)(=O)NC(Cn2cc(-c3ccccc3)c3ccccc32)C(F)(F)F)c(C)c1

HCID11504035

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-629e7253eb4d479584c603973f37839a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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