HRID2131558

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID81531

Diisopropylethylamine

C8H19N

HCID56763854

Spiro[piperidine-4,4'-pyrido[2,3-d][1,3]oxazin]-2'(1'H)-one

C11H13N3O2

结构：Cc1nc(Cl)cc(C(=O)c2cc(C)c3c(c2)oc(=O)n3C)n1

HCID58181137

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(C(=O)c2cc(C)c3c(c2)oc(=O)n3C)cc(N2CCC3(CC2)OC(=O)Nc2ncccc23)n1

HCID25265436

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8ead3819845945e0a87d4502a1ed5aa0
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

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