HRID195491

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

结构：CN(C)[P+](On1nnc2ccccc21)(N(C)C)N(C)C

HCID124335

Benzotriazol-1-yloxy-tris(dimethylamino)phosphonium

C12H22N6OP+

HCID18977245

2,6-Diaminopyridine-3-carboxylic acid

C6H7N3O2

HCID23130578

未命名化合物

PRODUCTS

生成物

结构：Nc1ccc(C(=O)NCc2ccc(Oc3ccc(F)cc3)o2)c(N)n1

HCID23130465

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7be4f2e2c30b4bfa9f0b84199405895f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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