HRID672036

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID58447786

未命名化合物

HCID59259225

5-(Pyrazin-2-yl)pyridin-2-amine

C9H8N4

PRODUCTS

生成物

结构：O=C(Cc1cnc(-c2ccnc(F)c2)c(F)c1)Nc1ccc(-c2cnccn2)cn1

HCID46927365

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bfbb41cbc5054ad8b11d97917cb80f2e
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

[CH2:32]1[CH2:33][CH2:34][CH:35]([N:36]=[C:37]=[N:38][CH:39]2[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44]2)[CH2:45][CH2:46]1.[CH3:47][N:48]([CH3:49])[c:50]1[cH:51][cH:52][n:53][cH:54][cH:55]1.[F:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[n:9][cH:10][c:11]([CH2:15][C:16](=[O:17])[OH:18])[cH:12][c:13]2[F:14])[cH:7]1.[O:56]=[CH:57][N:58]([CH3:59])[CH3:60].[n:19]1[c:20](-[c:25]2[cH:26][cH:27][c:28]([NH2:31])[n:29][cH:30]2)[cH:21][n:22][cH:23][cH:24]1>>[F:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[n:9][cH:10][c:11]([CH2:15][C:16](=[O:18])[NH:31][c:28]3[cH:27][cH:26][c:25](-[c:20]4[n:19][cH:24][cH:23][n:22][cH:21]4)[cH:30][n:29]3)[cH:12][c:13]2[F:14])[cH:7]1