HRID1569624

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

反应SMILES：FC(F)(F)c1cc(CBr)cc(C(F)(F)F)c1

HCID122573

3,5-Bis(trifluoromethyl)benzyl bromide

C9H5BrF6

HCID166653

Hydride

H-

反应SMILES：N#CC1CC2(c3ccccc3)C(O)CCC1N2Cc1ccccc1

HCID69684778

未命名化合物

PRODUCTS

产物

反应SMILES：N#CC1CC2(c3ccccc3)C(OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CCC1N2Cc1ccccc1

HCID88039822

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-3bafb06d671f4488a564ff9d70fafbb6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应SMILES

[CH2:19]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[N:26]1[C:27]2([c:37]3[cH:38][cH:39][cH:40][cH:41][cH:42]3)[CH:28]([OH:36])[CH2:29][CH2:30][CH:31]1[CH:32]([C:34]#[N:35])[CH2:33]2.[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[F:3][C:4]([c:5]1[cH:6][c:7]([CH2:8][Br:9])[cH:10][c:11]([C:13]([F:14])([F:15])[F:16])[cH:12]1)([F:17])[F:18].[H-:1].[Na+:2]>>[F:3][C:4]([c:5]1[cH:6][c:7]([CH2:8][O:36][CH:28]2[C:27]3([c:37]4[cH:38][cH:39][cH:40][cH:41][cH:42]4)[N:26]([CH2:19][c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[CH:31]([CH2:30][CH2:29]2)[CH:32]([C:34]#[N:35])[CH2:33]3)[cH:10][c:11]([C:13]([F:14])([F:15])[F:16])[cH:12]1)([F:17])[F:18]