HRID694959

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID16028

Tetrabutylammonium

C16H36N+

HCID28179

Fluoride

F-

结构：CC(CO[Si](C)(C)C(C)(C)C)OCC(Oc1ncnc2c1cnn2-c1ncccc1Cl)C(=O)Nc1ccc(C#N)cn1

HCID76550491

未命名化合物

PRODUCTS

生成物

结构：CC(CO)OCC(Oc1ncnc2c1cnn2-c1ncccc1Cl)C(=O)Nc1ccc(C#N)cn1

HCID76541546

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7bc230f5417a43c0bdc36f1d4bc14d49
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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