HRID2127320

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID260

Hydrogen Bromide

BrH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID96595

3,5-Difluoroaniline

C6H5F2N

结构：CC(Br)c1cc(C(=O)N(C)C)cc2c(=O)cc(N3CCOCC3)oc12

HCID58234987

未命名化合物

PRODUCTS

生成物

结构：CC(Nc1cc(F)cc(F)c1)c1cc(C(=O)N(C)C)cc2c(=O)cc(N3CCOCC3)oc12

HCID52913929

8-[1-(3,5-Difluoroanilino)ethyl]-N,N-dimethyl-2-(4-morpholinyl)-4-oxo-4H-chromene-6-carboxamide

C24H25F2N3O4

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1aa8880f068e43c28beccf77327b0122
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[Br:2][CH:3]([CH3:4])[c:5]1[cH:6][c:7]([C:22](=[O:23])[N:24]([CH3:25])[CH3:26])[cH:8][c:9]2[c:10](=[O:21])[cH:11][c:12]([N:15]3[CH2:16][CH2:17][O:18][CH2:19][CH2:20]3)[o:13][c:14]12.[BrH:1].[F:27][c:28]1[cH:29][c:30]([NH2:31])[cH:32][c:33]([F:35])[cH:34]1.[O:36]=[CH:37][N:38]([CH3:39])[CH3:40]>>[CH:3]([CH3:4])([c:5]1[cH:6][c:7]([C:22](=[O:23])[N:24]([CH3:25])[CH3:26])[cH:8][c:9]2[c:10](=[O:21])[cH:11][c:12]([N:15]3[CH2:16][CH2:17][O:18][CH2:19][CH2:20]3)[o:13][c:14]12)[NH:31][c:30]1[cH:29][c:28]([F:27])[cH:34][c:33]([F:35])[cH:32]1