HRID2135939

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID3283

Diethyl Ether

C4H10O

HCID6342

Acetonitrile

C2H3N

HCID8471

Triethylamine

C6H15N

HCID11776

Triphenylphosphine

C18H15P

2 次

HCID16028

Tetrabutylammonium

C16H36N+

HCID24290

未命名化合物

HCID24350

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

CuI

HCID28179

Fluoride

F-

2 次

HCID14601970

未命名化合物

HCID14643579

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(C#Cc2cnc(-c3ccc(C(F)(F)F)cc3)s2)s1

HCID14405351

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a574c6da1e864190a231605e3df37359
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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