HRID822646

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID53629639

(Azetidin-1-yl)(5-bromopyrimidin-2-yl)methanone

C8H8BrN3O

HCID59127183

3-Hydroxy-N-(1-methyl-1H-pyrazol-3-yl)-5-[(propan-2-yl)oxy]benzamide

C14H17N3O3

PRODUCTS

生成物

结构：CC(C)Oc1cc(Oc2cnc(C(=O)N3CCC3)nc2)cc(C(=O)Nc2ccn(C)n2)c1

HCID53629539

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5aac3d2f23b24354a002ad92e3466e52
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:34](=[O:35])([O-:36])[O-:37].[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45].[Cs+:38].[Cs+:39].[N:21]1([C:25](=[O:26])[c:27]2[n:28][cH:29][c:30]([Br:33])[cH:31][n:32]2)[CH2:22][CH2:23][CH2:24]1.[OH2:46].[OH:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[n:9][n:10]([CH3:13])[cH:11][cH:12]2)[cH:14][c:15]([O:17][CH:18]([CH3:19])[CH3:20])[cH:16]1>>[O:1]([c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[n:9][n:10]([CH3:13])[cH:11][cH:12]2)[cH:14][c:15]([O:17][CH:18]([CH3:19])[CH3:20])[cH:16]1)[c:30]1[cH:29][n:28][c:27]([C:25]([N:21]2[CH2:22][CH2:23][CH2:24]2)=[O:26])[n:32][cH:31]1