HRID1122817

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1049

Pyridine

C5H5N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID2777241

2-(Trifluoromethoxy)benzoyl Chloride

C8H4ClF3O2

HCID86612468

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1nc(-c2ccco2)c(C(=O)C2CCOCC2)s1)c1ccccc1OC(F)(F)F

HCID23144208

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f2fdf0590a884085b9826e2758379653
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH3:35][N:36]([c:37]1[cH:38][cH:39][n:40][cH:41][cH:42]1)[CH3:43].[F:20][C:21]([O:22][c:23]1[c:24]([C:25](=[O:26])[Cl:27])[cH:28][cH:29][cH:30][cH:31]1)([F:32])[F:33].[O:1]1[CH2:2][CH2:3][CH:4]([C:7](=[O:8])[c:9]2[c:10](-[c:15]3[o:16][cH:17][cH:18][cH:19]3)[n:11][c:12]([NH2:14])[s:13]2)[CH2:5][CH2:6]1.[OH2:34].[cH:44]1[cH:45][cH:46][n:47][cH:48][cH:49]1>>[O:1]1[CH2:2][CH2:3][CH:4]([C:7](=[O:8])[c:9]2[c:10](-[c:15]3[o:16][cH:17][cH:18][cH:19]3)[n:11][c:12]([NH:14][C:25]([c:24]3[c:23]([O:22][C:21]([F:20])([F:32])[F:33])[cH:31][cH:30][cH:29][cH:28]3)=[O:26])[s:13]2)[CH2:5][CH2:6]1