HRID937958

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID887

Methanol

CH4O

HCID8471

Triethylamine

C6H15N

HCID2760465

Ethyl (piperidin-4-yl)acetate

C9H17NO2

结构：COc1nc(Cl)nc(Nc2ccc(-n3cnc(C)c3)c(OC)c2)n1

HCID86640783

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CC1CCN(c2nc(Nc3ccc(-n4cnc(C)c4)c(OC)c3)nc(OC)n2)CC1

HCID45274964

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-519e293051eb419faef07e44dbfbf250
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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