HRID810157

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID8255

Isobutene

C4H8

HCID8857

Ethyl acetate

C4H8O2

HCID13396

Benzonitrile, 4-amino-

C7H6N2

HCID76583

3-Bromobenzaldehyde

C7H5BrO

HCID105055

Ytterbium(3+)

Yb+3

HCID2758875

Trifluoromethanesulfonate

CF3O3S-

3 次

PRODUCTS

生成物

结构：CC1(C)CC(c2cccc(Br)c2)Nc2ccc(C#N)cc21

HCID67292111

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0182c8dc586e4783a8a29ac0b237085b
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[Br:10][c:11]1[cH:12][c:13]([CH:14]=[O:15])[cH:16][cH:17][cH:18]1.[CH2:19]=[C:20]([CH3:21])[CH3:22].[CH3:48][C:49]#[N:50].[CH3:51][CH2:52][O:53][C:54](=[O:55])[CH3:56].[F:23][C:24]([F:25])([F:26])[S:27]([O-:28])(=[O:29])=[O:30].[F:32][C:33]([F:34])([F:35])[S:36]([O-:37])(=[O:38])=[O:39].[F:40][C:41]([F:42])([F:43])[S:44]([O-:45])(=[O:46])=[O:47].[NH2:1][c:2]1[cH:3][cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1.[Yb+3:31]>>[NH:1]1[c:2]2[cH:3][cH:4][c:5]([C:6]#[N:7])[cH:8][c:9]2[C:20]([CH3:21])([CH3:22])[CH2:19][CH:14]1[c:13]1[cH:12][c:11]([Br:10])[cH:18][cH:17][cH:16]1