HRID808825

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8058

n-Hexane

C6H14

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID2777432

N-{Hydroxy[3-(trifluoromethyl)phenyl]methylidene}glycine

C10H8F3NO3

HCID53417413

tert-Butyl 3-amino-3-(fluoromethyl)pyrrolidine-1-carboxylate

C10H19FN2O2

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(CF)(NC(=O)CNC(=O)c2cccc(C(F)(F)F)c2)C1

HCID59556186

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5ae3e6dc460f45248dc6a3a5661d4b90
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:46]([O:47][CH2:48][CH3:49])(=[O:50])[CH3:51].[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH3:40][CH2:41][CH2:42][CH2:43][CH2:44][CH3:45].[F:16][C:17]([c:18]1[cH:19][c:20]([C:21](=[O:22])[NH:23][CH2:24][C:25](=[O:26])[OH:27])[cH:28][cH:29][cH:30]1)([F:31])[F:32].[NH2:1][C:2]1([CH2:14][F:15])[CH2:3][N:4]([C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[CH2:5][CH2:6]1.[O:52]=[CH:53][N:54]([CH3:55])[CH3:56]>>[NH:1]([C:2]1([CH2:14][F:15])[CH2:3][N:4]([C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[CH2:5][CH2:6]1)[C:25]([CH2:24][NH:23][C:21]([c:20]1[cH:19][c:18]([C:17]([F:16])([F:31])[F:32])[cH:30][cH:29][cH:28]1)=[O:22])=[O:26]