HRID178498

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID11773

Triphenylarsine

C18H15As

HCID13387

N-Methyl-2-pyrrolidone

C5H9NO

HCID23938

Palladium

2 次

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID95417

1,5-Diphenyl-1,4-pentadien-3-one

C17H14O

3 次

HCID10868445

3-(Trimethylstannyl)pyridine

C8H13NSn

HCID21877971

未命名化合物

PRODUCTS

生成物

结构：NC(=O)C1CN(c2ccc(-c3cccnc3)c(F)c2)C(=O)O1

HCID21877916

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a5fcb29efdad40e2ae8b5f770ff887d7
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

[CH3:18][Sn:19]([c:20]1[cH:21][n:22][cH:23][cH:24][cH:25]1)([CH3:26])[CH3:27].[CH3:47][N:48]1[CH2:49][CH2:50][CH2:51][C:52]1=[O:53].[Cu:111][I:112].[F:1][c:2]1[cH:3][c:4]([N:9]2[C:10](=[O:17])[O:11][CH:12]([C:14](=[O:15])[NH2:16])[CH2:13]2)[cH:5][cH:6][c:7]1[I:8].[O:57]=[C:58]([CH:59]=[CH:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1)[CH:67]=[CH:68][c:69]1[cH:70][cH:71][cH:72][cH:73][cH:74]1.[O:75]=[C:76]([CH:77]=[CH:78][c:79]1[cH:80][cH:81][cH:82][cH:83][cH:84]1)[CH:85]=[CH:86][c:87]1[cH:88][cH:89][cH:90][cH:91][cH:92]1.[O:93]=[C:94]([CH:95]=[CH:96][c:97]1[cH:98][cH:99][cH:100][cH:101][cH:102]1)[CH:103]=[CH:104][c:105]1[cH:106][cH:107][cH:108][cH:109][cH:110]1.[OH2:54].[Pd:55].[Pd:56].[cH:28]1[cH:29][cH:30][c:31]([As:32]([c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[cH:45][cH:46]1>>[F:1][c:2]1[cH:3][c:4]([N:9]2[C:10](=[O:17])[O:11][CH:12]([C:14](=[O:15])[NH2:16])[CH2:13]2)[cH:5][cH:6][c:7]1-[c:20]1[cH:21][n:22][cH:23][cH:24][cH:25]1