HRID1212984

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID63947415

未命名化合物

反应SMILES：O=C(O)c1cnn2c(C(F)F)cc(-c3ccc(C(F)(F)F)cc3)nc12

HCID66650268

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1nc(NC(=O)c2cnn3c(C(F)F)cc(-c4ccc(C(F)(F)F)cc4)nc23)sc1S(=O)(=O)N(C)CCO

HCID11996717

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-6536c34f3d7a4629935cc9b10b51fbde
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应SMILES

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