HRID1152700

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID11126702

未命名化合物

反应SMILES：COCCOc1cccc2ccc(CC(CBr)C(C)C)cc12

HCID66888403

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

产物

反应SMILES：CCOC1=NC(CC(Cc2ccc3cccc(OCCOC)c3c2)C(C)C)C(OCC)=NC1

HCID66887787

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-21866c6ed7054f98a0a540da0d91118b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应SMILES

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