HRID290428

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

HCID11043912

4-[2-(Morpholin-4-yl)ethoxy]naphthalen-1-amine

C16H20N2O2

HCID18422079

2-Chloro-6-(4-morpholinyl)-4-pyrimidinecarboxylic acid

C9H10ClN3O3

PRODUCTS

生成物

结构：O=C(Nc1ccc(OCCN2CCOCC2)c2ccccc12)c1cc(N2CCOCC2)nc(Cl)n1

HCID59553236

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-321d71b2dace45aea6cdde49e2d8ba6f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH:41]([N:42]([CH:43]([CH3:44])[CH3:45])[CH2:46][CH3:47])([CH3:48])[CH3:49].[Cl:1][c:2]1[n:3][c:4]([N:11]2[CH2:12][CH2:13][O:14][CH2:15][CH2:16]2)[cH:5][c:6]([C:8](=[O:9])[OH:10])[n:7]1.[O:50]1[CH2:51][CH2:52][N:53]([CH2:56][CH2:57][O:58][c:59]2[cH:60][cH:61][c:62]([NH2:69])[c:63]3[cH:64][cH:65][cH:66][cH:67][c:68]23)[CH2:54][CH2:55]1.[O:70]=[CH:71][N:72]([CH3:73])[CH3:74].[OH2:75].[P-:17]([F:18])([F:19])([F:20])([F:21])([F:22])[F:23].[n:24]1([O:25][C:26]([N:27]([CH3:28])[CH3:29])=[N+:30]([CH3:31])[CH3:32])[c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]2[n:39][n:40]1>>[Cl:1][c:2]1[n:3][c:4]([N:11]2[CH2:12][CH2:13][O:14][CH2:15][CH2:16]2)[cH:5][c:6]([C:8](=[O:10])[NH:69][c:62]2[cH:61][cH:60][c:59]([O:58][CH2:57][CH2:56][N:53]3[CH2:52][CH2:51][O:50][CH2:55][CH2:54]3)[c:68]3[c:63]2[cH:64][cH:65][cH:66][cH:67]3)[n:7]1