HRID161094

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

反应SMILES：CS(=O)(=O)c1ccc(-n2ncc3c(Cl)ncnc32)cc1

HCID21897447

4-Chloro-1-[4-(methanesulfonyl)phenyl]-1H-pyrazolo[3,4-d]pyrimidine

C12H9ClN4O2S

HCID21897782

(3-Fluorophenyl)(4-hydroxypiperidin-1-yl)methanone

C12H14FNO2

PRODUCTS

产物

反应SMILES：CS(=O)(=O)c1ccc(-n2ncc3c(OC4CCN(C(=O)c5cccc(F)c5)CC4)ncnc32)cc1

HCID11340908

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-032bf888279b49ada0c602036b875d6f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

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