HRID1123545

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID888

Magnesium cation

Mg+2

HCID1117

Sulfate

O4S-2

HCID6344

Dichloromethane

CH2Cl2

HCID7863

Acetaldehyde oxime

C2H5NO

HCID8452

Cyclopentanone

C5H8O

HCID8471

Triethylamine

C6H15N

HCID31398

N-Chlorosuccinimide

C4H4ClNO2

HCID86247622

未命名化合物

PRODUCTS

产物

反应SMILES：CCOCc1nc2c(Cl)nc3ccccc3c2n1CCN1C(C)=NOC12CCCC2

HCID86616887

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-2daba889a77c400dbf8f4c49684bc132
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应SMILES

[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[CH:34]([CH3:35])=[N:36][OH:37].[Cl:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10]2[c:11]1[n:12][c:13]([CH2:18][O:19][CH2:20][CH3:21])[n:14]2[CH2:15][CH2:16][NH2:17].[Cl:38][N:39]1[C:40](=[O:41])[CH2:42][CH2:43][C:44]1=[O:45].[Cl:53][CH2:54][Cl:55].[Mg+2:28].[O-:29][S:30](=[O:31])(=[O:32])[O-:33].[O:22]=[C:23]1[CH2:24][CH2:25][CH2:26][CH2:27]1>>[Cl:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10]2[c:11]1[n:12][c:13]([CH2:18][O:19][CH2:20][CH3:21])[n:14]2[CH2:15][CH2:16][N:17]1[C:23]2([O:22][N:36]=[C:34]1[CH3:35])[CH2:24][CH2:25][CH2:26][CH2:27]2