HRID1211674

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID11472

4-Pyridinemethanol

C6H7NO

HCID13831

Tributylphosphine

C12H27P

HCID73042

1,1′-(1,2-Diazenediyl)bis[1-(1-piperidinyl)methanone]

C12H20N4O2

HCID17389890

Ethyl 5-(trifluoromethyl)-1H-indole-2-carboxylate

C12H10F3NO2

PRODUCTS

生成物

结构：CCOC(=O)c1cc2cc(C(F)(F)F)ccc2n1Cc1ccncc1

HCID68431838

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-20336de390004230a80dd67efc6477d0
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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