HRID88359

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID7369

Benzenesulfonyl chloride

C6H5ClO2S

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

结构：CC(C)(C)OC(=O)N1CCC=C(Cc2c[nH]c3ccc(F)cc23)C1

HCID12085354

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC=C(Cc2cn(S(=O)(=O)c3ccccc3)c3ccc(F)cc23)C1

HCID12085355

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8c163136033642bd9d9914e83932d6f6
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

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