HRID676470

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6422

Trifluoroacetic acid

C2HF3O2

HCID7519

Anisole

C7H8O

HCID2723788

4-Pyridinecarbothioamide

C6H6N2S

HCID178459651

未命名化合物

PRODUCTS

产物

HCID178459656

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-87adc6c2253b45658b5eeaf9b1b46a20
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

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