HRID1239363

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID16028

Tetrabutylammonium

C16H36N+

HCID28179

Fluoride

F-

结构：CC(C)(C)[Si](C)(C)Oc1cccc2ccc(-c3nnc4ccc(F)cn34)nc12

HCID67231132

未命名化合物

PRODUCTS

生成物

HCID136337806

8-Quinolinol, 2-(6-fluoro-1,2,4-triazolo[4,3-a]pyridin-3-yl)-

C15H9FN4O

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b9892ae7f61245dcac5bdaab42ff84f4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:1]([Si:2]([CH3:3])([CH3:4])[O:6][c:7]1[cH:8][cH:9][cH:10][c:11]2[cH:12][cH:13][c:14](-[c:17]3[n:18][n:19][c:20]4[n:21]3[cH:22][c:23]([F:26])[cH:24][cH:25]4)[n:15][c:16]12)([CH3:5])([CH3:27])[CH3:28].[CH2:29]1[O:30][CH2:31][CH2:32][CH2:33]1.[CH2:35]([N+:36]([CH2:37][CH2:38][CH2:39][CH3:40])([CH2:41][CH2:42][CH2:43][CH3:44])[CH2:45][CH2:46][CH2:47][CH3:48])[CH2:49][CH2:50][CH3:51].[CH3:57][CH2:58][O:59][C:60]([CH3:61])=[O:62].[F-:34].[Na+:56].[O-:52][C:53]([OH:54])=[O:55].[OH2:63]>>[OH:6][c:7]1[cH:8][cH:9][cH:10][c:11]2[cH:12][cH:13][c:14](-[c:17]3[n:18][n:19][c:20]4[n:21]3[cH:22][c:23]([F:26])[cH:24][cH:25]4)[n:15][c:16]12