HRID1561974

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID15512811

tert-Butyl 4-(bromomethyl)piperidine-1-carboxylate

C11H20BrNO2

HCID178513840

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(Cn2nc(C(N)=O)c3c2-c2nc(I)ncc2CC3)CC1

HCID86668391

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e8b08fd92888489698ecad2da714040c
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

[Br:18][CH2:19][CH:20]1[CH2:21][CH2:22][N:23]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:24][CH2:25]1.[C:33](=[O:34])([O-:35])[O-:36].[Cs+:37].[Cs+:38].[I:1][c:2]1[n:3][c:4]2[c:9]([cH:10][n:11]1)[CH2:8][CH2:7][c:6]1[c:5]-2[nH:14][n:13][c:12]1[C:15](=[O:16])[NH2:17].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44].[OH2:39]>>[I:1][c:2]1[n:3][c:4]2[c:9]([cH:10][n:11]1)[CH2:8][CH2:7][c:6]1[c:5]-2[n:14]([CH2:19][CH:20]2[CH2:21][CH2:22][N:23]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:24][CH2:25]2)[n:13][c:12]1[C:15](=[O:16])[NH2:17]