HRID111194

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID26297

2-Chloro-2-oxoethyl acetate

C4H5ClO3

结构：O=C1OC(COc2ccon2)CN1c1ccc(N2CCNCC2)c(F)c1

HCID57110370

3-(3-Fluoro-4-piperazin-1-ylphenyl)-5-(1,2-oxazol-3-yloxymethyl)-1,3-oxazolidin-2-one

C17H19FN4O4

PRODUCTS

生成物

结构：CC(=O)OCC(=O)N1CCN(c2ccc(N3CC(COc4ccon4)OC3=O)cc2F)CC1

HCID57316774

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d35e33531c3a41ebb18be90f1a59e142
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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