HRID672919

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

反应SMILES：O=S(=O)(OS(=O)(=O)C(F)(F)F)C(F)(F)F

HCID67749

Trifluoromethanesulfonic anhydride

C2F6O5S2

反应SMILES：O=C(NC(=S)NC1(c2cccc(F)c2F)COC(C(F)(F)F)C1CO)c1ccccc1

HCID123321523

未命名化合物

PRODUCTS

产物

反应SMILES：O=C(NC1=NC2(c3cccc(F)c3F)COC(C(F)(F)F)C2CS1)c1ccccc1

HCID77977347

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-a26162b9f8694d20bdcaa5195154e02e
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

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