HRID1230133

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID2724942

未命名化合物

HCID11542782

3-methylazetidin-3-ol

C4H9NO

结构：COc1ccc(-c2nnc(C(=O)N3CC(Oc4ccc(C=O)c(C)c4)C3)o2)cc1

HCID58043156

Benzaldehyde, 4-[[1-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]carbonyl]-3-azetidinyl]oxy]-2-methyl-

C21H19N3O5

PRODUCTS

生成物

结构：COc1ccc(-c2nnc(C(=O)N3CC(Oc4ccc(CN5CC(C)(O)C5)c(C)c4)C3)o2)cc1

HCID56597275

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8ed4c9f79ccb4b2eac45bdb46472e3cc
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:44]([O:45][BH-:46]([O:47][C:48](=[O:49])[CH3:50])[O:51][C:52](=[O:53])[CH3:54])(=[O:55])[CH3:56].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[n:10][n:11][c:12]([C:14](=[O:15])[N:16]3[CH2:17][CH:18]([O:20][c:21]4[cH:22][c:23]([CH3:29])[c:24]([CH:25]=[O:26])[cH:27][cH:28]4)[CH2:19]3)[o:13]2)[cH:7][cH:8]1.[CH3:31][C:32]1([OH:36])[CH2:33][NH:34][CH2:35]1.[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[Cl:58][CH2:59][Cl:60].[ClH:30].[Na+:57]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[n:10][n:11][c:12]([C:14](=[O:15])[N:16]3[CH2:17][CH:18]([O:20][c:21]4[cH:22][c:23]([CH3:29])[c:24]([CH2:25][N:34]5[CH2:33][C:32]([CH3:31])([OH:36])[CH2:35]5)[cH:27][cH:28]4)[CH2:19]3)[o:13]2)[cH:7][cH:8]1