HRID166059

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8058

Hexane

C6H14

HCID8300

2-Methoxyprop-1-ene

C4H8O

HCID10451

1,3-Dithiane

C4H8S2

HCID2757014

5-Bromo-2-hydroxybenzonitrile

C7H4BrNO

HCID19735097

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

产物

HCID19735097

未命名化合物

HCID19735126

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-0a3f4637841b4d32b624a07cf19580d1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

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