HRID961780

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-

HCID66853

Benzenemethanamine, 3-fluoro-

C7H8FN

HCID81531

Diisopropylethylamine

C8H19N

HCID504301

(4-PYRIDIN-2-YL-PHENYL)-ACETIC ACID

C13H11NO2

结构：c1ccc2c(c1)nnn2O[P+](N1CCCC1)(N1CCCC1)N1CCCC1

HCID2724700

未命名化合物

PRODUCTS

生成物

结构：O=C(Cc1ccc(-c2ccccn2)cc1)NCc1cccc(F)c1

HCID11674154

N-(3-Fluoro-benzyl)-2-(4-pyridin-2-yl-phenyl)-acetamide

C20H17FN2O

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6c9229ac2e3f4036a08481c8403f2d23
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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