HRID2154951

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID3776

Isopropanol

C3H8O

HCID8028

Tetrahydrofuran

C4H8O

HCID15413

Methyl tert-butyl ether

C5H12O

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID45083592

[1,2,4]Triazolo[1,5-a]pyridine-6-carbaldehyde

C7H5N3O

结构：Cc1cccc(C(Nc2ccccc2)P(=O)(Oc2ccccc2)Oc2ccccc2)n1

HCID58748142

Diphenyl [anilino(6-methylpyridin-2-yl)methyl]phosphonate

C25H23N2O3P

PRODUCTS

生成物

HCID66632566

1-(6-Methylpyridin-2-yl)-2-([1,2,4]triazolo[1,5-a]pyridin-6-yl)ethan-1-one

C14H12N4O

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e27810fd279b42fd9aa5c20fec2fefe4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[C:43]([O-:44])(=[O:45])[O-:46].[C:59]([O:60][CH3:61])([CH3:62])([CH3:63])[CH3:64].[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH:55]([OH:56])([CH3:57])[CH3:58].[ClH:49].[Cs+:47].[Cs+:48].[c:12]1([O:13][P:14](=[O:22])([O:23][c:24]2[cH:25][cH:26][cH:27][cH:29][cH:30]2)[CH:28]([NH:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:36]2[n:37][c:38]([CH3:42])[cH:39][cH:40][cH:41]2)[cH:31][cH:32][cH:33][cH:34][cH:35]1.[n:1]1[cH:2][n:3][n:4]2[c:5]1[cH:6][cH:7][c:8]([CH:10]=[O:11])[cH:9]2>>[n:1]1[cH:2][n:3][n:4]2[c:5]1[cH:6][cH:7][c:8]([CH2:10][C:28]([c:36]1[n:37][c:38]([CH3:42])[cH:39][cH:40][cH:41]1)=[O:44])[cH:9]2