HRID206368

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID81531

Diisopropylethylamine

C8H19N

结构：O=C(O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F

HCID24811740

2-Fluoro-5-[(4-oxo-3,4-dihydrophthalazin-1-yl)methyl]benzoic acid

C16H11FN2O3

HCID64042432

未命名化合物

PRODUCTS

生成物

结构：COCC(C)OC1CCN(C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)CC1

HCID68791846

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0d600da8aec44155a2349e321eb386bd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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