HRID93997

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

Trifluoroacetic acid

C2HF3O2

HCID12052

Silane, triethyl-

C6H16Si

HCID57969705

未命名化合物

PRODUCTS

产物

HCID57969638

2-(3-(1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl)-2-methylbutanenitrile

C17H16N4

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-b7689c167c4b4c099cd0777f8208816e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

[CH2:41]([SiH:42]([CH2:43][CH3:44])[CH2:45][CH3:46])[CH3:47].[CH3:1][C:2]([C:3]#[N:4])([CH2:5][CH3:6])[c:7]1[cH:8][c:9](-[c:13]2[c:14]3[c:15]([n:16][cH:17][cH:18]2)[n:19]([C:22]([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[n:20][cH:21]3)[cH:10][cH:11][cH:12]1.[Cl:55][CH2:56][Cl:57].[OH:48][C:49]([C:50]([F:51])([F:52])[F:53])=[O:54]>>[CH3:1][C:2]([C:3]#[N:4])([CH2:5][CH3:6])[c:7]1[cH:8][c:9](-[c:13]2[c:14]3[c:15]([n:16][cH:17][cH:18]2)[nH:19][n:20][cH:21]3)[cH:10][cH:11][cH:12]1