HRID934731

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID31297

Methanesulfonyl chloride

CH3ClO2S

结构：CN(Cc1cc(-c2cccc(C=NO)c2F)n(S(=O)(=O)c2cccnc2)c1)C(=O)OC(C)(C)C

HCID86631005

未命名化合物

PRODUCTS

生成物

结构：CN(Cc1cc(-c2cccc(C#N)c2F)n(S(=O)(=O)c2cccnc2)c1)C(=O)OC(C)(C)C

HCID66974580

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-21707c83e5a842eab05c40f10280b074
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:42][S:43](=[O:44])(=[O:45])[Cl:46].[F:1][c:2]1[c:3](-[c:11]2[cH:12][c:13]([CH2:25][N:26]([C:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[CH3:34])[cH:14][n:15]2[S:16](=[O:17])(=[O:18])[c:19]2[cH:20][n:21][cH:22][cH:23][cH:24]2)[cH:4][cH:5][cH:6][c:7]1[CH:8]=[N:9][OH:10].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1.[OH2:47]>>[F:1][c:2]1[c:3](-[c:11]2[cH:12][c:13]([CH2:25][N:26]([C:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[CH3:34])[cH:14][n:15]2[S:16](=[O:17])(=[O:18])[c:19]2[cH:20][n:21][cH:22][cH:23][cH:24]2)[cH:4][cH:5][cH:6][c:7]1[C:8]#[N:9]