HRID823002

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID244

Benzyl alcohol

C7H8O

HCID923

Sodium ion

Na+

HCID31374

Dimethylacetamide

C4H9NO

HCID81531

Diisopropylethylamine

C8H19N

HCID166653

Hydride

H-

结构：Cc1nc(-c2cncc(I)n2)sc1C(=O)NCc1ccc(F)cc1

HCID86645558

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(-c2cncc(OCc3ccccc3)n2)sc1C(=O)NCc1ccc(F)cc1

HCID24955767

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6e8e9feec92142ae9636da7a45d9d69d
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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