HRID697982

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

HCID36872

1-Bromo-1-chloropropane

C3H6BrCl

HCID104967

Cesium(1+)

Cs+

2 次

HCID21911029

未命名化合物

HCID58719565

5-Phenyldihydropyrimidine-2,4(1H,3H)-dione

C10H10N2O2

PRODUCTS

生成物

结构：CCCc1c(OCCCN2C(=O)NCC(c3ccccc3)C2=O)ccc2c(C(F)(F)F)noc12

HCID21911016

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c89d055086e54b82b30c0732a5dd4121
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[Br:22][CH:23]([Cl:24])[CH2:25][CH3:26].[C:41](=[O:42])([O-:43])[O-:44].[Cl:1][CH2:2][CH2:3][CH2:4][O:5][c:6]1[c:7]([CH2:19][CH2:20][CH3:21])[c:8]2[c:9]([c:10]([C:13]([F:14])([F:15])[F:16])[n:11][o:12]2)[cH:17][cH:18]1.[Cs+:45].[Cs+:46].[O:47]=[CH:48][N:49]([CH3:50])[CH3:51].[OH2:52].[c:27]1([CH:33]2[C:34](=[O:40])[NH:35][C:36](=[O:39])[NH:37][CH2:38]2)[cH:28][cH:29][cH:30][cH:31][cH:32]1>>[CH2:2]([CH2:3][CH2:4][O:5][c:6]1[c:7]([CH2:19][CH2:20][CH3:21])[c:8]2[c:9]([c:10]([C:13]([F:14])([F:15])[F:16])[n:11][o:12]2)[cH:17][cH:18]1)[N:35]1[C:34](=[O:40])[CH:33]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[CH2:38][NH:37][C:36]1=[O:39]