HRID1228025

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID19660

Carbonate

CO3-2

HCID93146

1H-Pyrazol-3-amine, 5-methyl-

C4H7N3

HCID104967

Cesium(1+)

Cs+

2 次

结构：CNC(=O)c1ccc(-c2cc(OC)c(Nc3ncc(C(F)(F)F)c(Cl)n3)cc2C)cc1

HCID86647793

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)c1ccc(-c2cc(OC)c(Nc3ncc(C(F)(F)F)c(Nc4cc(C)[nH]n4)n3)cc2C)cc1

HCID25265405

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8efd0383f9194ac1b0a3763ef8d1ac09
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:39](=[O:40])([O-:41])[O-:42].[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[CH3:32][c:33]1[cH:34][c:35]([NH2:38])[n:36][nH:37]1.[Cl:1][c:2]1[n:3][c:4]([NH:12][c:13]2[cH:14][c:15]([CH3:31])[c:16](-[c:21]3[cH:22][cH:23][c:24]([C:27](=[O:28])[NH:29][CH3:30])[cH:25][cH:26]3)[cH:17][c:18]2[O:19][CH3:20])[n:5][cH:6][c:7]1[C:8]([F:9])([F:10])[F:11].[Cs+:43].[Cs+:44]>>[c:2]1([NH:38][c:35]2[cH:34][c:33]([CH3:32])[nH:37][n:36]2)[n:3][c:4]([NH:12][c:13]2[cH:14][c:15]([CH3:31])[c:16](-[c:21]3[cH:22][cH:23][c:24]([C:27](=[O:28])[NH:29][CH3:30])[cH:25][cH:26]3)[cH:17][c:18]2[O:19][CH3:20])[n:5][cH:6][c:7]1[C:8]([F:9])([F:10])[F:11]