HRID817784

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID24614

Phosphorus tribromide

Br3P

结构：CCOC(=O)c1nn(-c2ccc(OC)cc2)c2c1CCN(c1ccc(N3CCCCC3=O)cc1)C2=O

HCID22240488

Ethyl 1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate

C27H28N4O5

PRODUCTS

生成物

结构：COc1ccc(-n2nc(C)c3c2C(=O)N(c2ccc(N4CCCCC4=O)cc2)CC3)cc1

HCID22240452

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f73757fe393646b69dcd59ee694fa081
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:49]([OH:50])(=[O:51])[CH3:52].[CH2:1]([O:2][C:4](=[O:3])[c:6]1[n:7][n:8](-[c:29]2[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]2)[c:9]2[c:14]1[CH2:13][CH2:12][N:11]([c:15]1[cH:16][cH:17][c:18]([N:21]3[C:22](=[O:27])[CH2:23][CH2:24][CH2:25][CH2:26]3)[cH:19][cH:20]1)[C:10]2=[O:28])[CH3:5].[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[Cl:37][CH2:38][Cl:39].[P:40]([Br:41])([Br:42])[Br:43]>>[CH3:4][c:6]1[n:7][n:8](-[c:29]2[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]2)[c:9]2[c:14]1[CH2:13][CH2:12][N:11]([c:15]1[cH:16][cH:17][c:18]([N:21]3[C:22](=[O:27])[CH2:23][CH2:24][CH2:25][CH2:26]3)[cH:19][cH:20]1)[C:10]2=[O:28]