HRID799031

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID962

Water

H2O

HCID8083

Morpholine

C4H9NO

HCID19660

Carbonate

CO3-2

HCID68510

2,6-Di-tert-butylpyridine

C13H21N

结构：COC1CC(S(=O)(=O)c2ccc(Br)cc2C(F)(F)F)CC1C(=O)NC1(C#N)CC1

HCID72340464

未命名化合物

PRODUCTS

生成物

结构：COC1CC(S(=O)(=O)c2ccc(N3CCOCC3)cc2C(F)(F)F)CC1C(=O)NC1(C#N)CC1

HCID178493625

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-47c6080e1a7a46d2b0c85403125f388e
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1](#[N:2])[C:3]1([NH:6][C:7](=[O:8])[CH:9]2[CH:10]([O:28][CH3:29])[CH2:11][CH:12]([S:14](=[O:15])(=[O:16])[c:17]3[c:18]([C:24]([F:25])([F:26])[F:27])[cH:19][c:20]([Br:23])[cH:21][cH:22]3)[CH2:13]2)[CH2:4][CH2:5]1.[C:36]([c:37]1[cH:38][cH:39][cH:40][c:41]([C:42]([CH3:43])([CH3:44])[CH3:45])[n:46]1)([CH3:47])([CH3:48])[CH3:49].[C:50](=[O:51])([O-:52])[O-:53].[CH2:30]1[CH2:31][O:32][CH2:33][CH2:34][NH:35]1.[Na+:54].[Na+:55].[OH2:56]>>[C:1](#[N:2])[C:3]1([NH:6][C:7](=[O:8])[CH:9]2[CH:10]([O:28][CH3:29])[CH2:11][CH:12]([S:14](=[O:15])(=[O:16])[c:17]3[c:18]([C:24]([F:25])([F:26])[F:27])[cH:19][c:20]([N:35]4[CH2:30][CH2:31][O:32][CH2:33][CH2:34]4)[cH:21][cH:22]3)[CH2:13]2)[CH2:4][CH2:5]1