HRID1142011

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID31297

Methanesulfonyl chloride

CH3ClO2S

结构：Nc1cccc(C2=Nc3ccc(-c4ccc(F)cc4)cc3NC(=O)C2)c1

HCID22224587

未命名化合物

PRODUCTS

生成物

结构：CS(=O)(=O)Nc1cccc(C2=Nc3ccc(-c4ccc(F)cc4)cc3NC(=O)C2)c1

HCID22224948

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-05f74f8b0b0d4fc0adb41f7c51debbea
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH3:27][S:28]([Cl:29])(=[O:30])=[O:31].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[NH2:1][c:2]1[cH:3][c:4]([C:8]2=[N:9][c:10]3[c:11]([cH:16][c:17](-[c:20]4[cH:21][cH:22][c:23]([F:26])[cH:24][cH:25]4)[cH:18][cH:19]3)[NH:12][C:13](=[O:15])[CH2:14]2)[cH:5][cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][c:4]([C:8]2=[N:9][c:10]3[c:11]([cH:16][c:17](-[c:20]4[cH:21][cH:22][c:23]([F:26])[cH:24][cH:25]4)[cH:18][cH:19]3)[NH:12][C:13](=[O:15])[CH2:14]2)[cH:5][cH:6][cH:7]1)[S:28]([CH3:27])(=[O:30])=[O:31]