HRID298388

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID31374

Dimethylacetamide

C4H9NO

HCID7018020

2,5-Dimethyl-1,3-oxazole-4-carbonyl chloride

C6H6ClNO2

结构：Nc1cc(Oc2ccc3nc(NC(=O)C4CC4)cn3n2)ccc1F

HCID57505446

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(C(=O)Nc2cc(Oc3ccc4nc(NC(=O)C5CC5)cn4n3)ccc2F)c(C)o1

HCID57505609

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-29ee8022180d4a878293f23793c88584
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH3:25][c:26]1[o:27][c:28]([CH3:34])[c:29]([C:31](=[O:32])[Cl:33])[n:30]1.[CH3:36][N:37]([CH3:38])[C:39](=[O:40])[CH3:41].[NH2:1][c:2]1[cH:3][c:4]([O:5][c:6]2[cH:7][cH:8][c:9]3[n:10]([n:11]2)[cH:12][c:13]([NH:15][C:16](=[O:17])[CH:18]2[CH2:19][CH2:20]2)[n:14]3)[cH:21][cH:22][c:23]1[F:24].[OH2:35]>>[NH:1]([c:2]1[cH:3][c:4]([O:5][c:6]2[cH:7][cH:8][c:9]3[n:10]([n:11]2)[cH:12][c:13]([NH:15][C:16](=[O:17])[CH:18]2[CH2:19][CH2:20]2)[n:14]3)[cH:21][cH:22][c:23]1[F:24])[C:31]([c:29]1[c:28]([CH3:34])[o:27][c:26]([CH3:25])[n:30]1)=[O:32]