HRID1556994

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID7505

Benzonitrile

C7H5N

HCID8028

Tetrahydrofuran

C4H8O

HCID24648

Sulfuryl chloride

Cl2O2S

HCID36336

1,4,7,10,13-Pentaoxacyclopentadecane

C10H20O5

HCID166653

Hydride

H-

HCID46908593

5-(2-Fluorophenyl)-1H-pyrrole-3-carboxaldehyde

C11H8FNO

PRODUCTS

生成物

结构：N#Cc1ccccc1S(=O)(=O)n1cc(C=O)cc1-c1ccccc1F

HCID86620783

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-781f13751b2742df9c980b9e8d5da1bd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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