HRID1541854

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID81531

Diisopropylethylamine

C8H19N

HCID4293995

3-[(Diethoxyphosphoryl)oxy]-1,2,3-benzotriazin-4(3H)-one

C11H14N3O5P

HCID10726887

1-BENZOYL-3-METHYLPIPERAZINE

C12H16N2O

HCID22476274

未命名化合物

PRODUCTS

生成物

结构：CC1CN(C(=O)c2ccccc2)CCN1C(=O)C(=O)c1c[nH]c2ncccc12

HCID5495836

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9c85983e746f458cac0e367c551e52da
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH2:31]([O:32][P:33]([O:34][n:35]1[c:36](=[O:37])[c:38]2[cH:39][cH:40][cH:41][cH:42][c:43]2[n:44][n:45]1)([O:46][CH2:47][CH3:48])=[O:49])[CH3:50].[CH3:16][CH:17]1[CH2:18][N:19]([C:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)=[O:30])[CH2:20][CH2:21][NH:22]1.[CH:51]([N:52]([CH2:53][CH3:54])[CH:55]([CH3:56])[CH3:57])([CH3:58])[CH3:59].[K+:15].[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[nH:1]1[cH:2][c:3]([C:10]([C:11](=[O:12])[O-:13])=[O:14])[c:4]2[cH:5][cH:6][cH:7][n:8][c:9]12>>[nH:1]1[cH:2][c:3]([C:10]([C:11](=[O:13])[N:22]2[CH:17]([CH3:16])[CH2:18][N:19]([C:23]([c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)=[O:30])[CH2:20][CH2:21]2)=[O:14])[c:4]2[cH:5][cH:6][cH:7][n:8][c:9]12