HRID2129860

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7912

Diisopropylamine

C6H15N

HCID24350

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

CuI

HCID58547697

未命名化合物

HCID58547788

Trimethyl[(3-methyloxetan-3-yl)ethynyl]silane

C9H16OSi

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

结构：CC1(C#Cc2nccnc2OC2CN(c3ccc4ccccc4n3)C2)COC1

HCID54670578

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6c7c4dfdf3744673b325f674c715760f
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

[CH3:30][Si:31]([C:32]#[C:33][C:34]1([CH3:38])[CH2:35][O:36][CH2:37]1)([CH3:39])[CH3:40].[CH:23]([NH:24][CH:25]([CH3:26])[CH3:27])([CH3:28])[CH3:29].[Cl:1][c:2]1[c:3]([O:8][CH:9]2[CH2:10][N:11]([c:13]3[n:14][c:15]4[cH:16][cH:17][cH:18][cH:19][c:20]4[cH:21][cH:22]3)[CH2:12]2)[n:4][cH:5][cH:6][n:7]1.[Cu:118][I:119].[cH:41]1[cH:42][cH:43][c:44]([P:45]([Pd:46]([P:47]([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)([c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)([P:66]([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)([c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)[P:85]([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)([c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)([c:104]2[cH:105][cH:106][cH:107][cH:108][cH:109]2)[c:110]2[cH:111][cH:112][cH:113][cH:114][cH:115]2)[cH:116][cH:117]1>>[c:2]1([C:32]#[C:33][C:34]2([CH3:38])[CH2:35][O:36][CH2:37]2)[c:3]([O:8][CH:9]2[CH2:10][N:11]([c:13]3[n:14][c:15]4[cH:16][cH:17][cH:18][cH:19][c:20]4[cH:21][cH:22]3)[CH2:12]2)[n:4][cH:5][cH:6][n:7]1