HRID317185

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

结构：CC(C)(C)OC(=O)C(C)(C)Sc1nc(COCc2ccc(-c3ccc(C(F)(F)F)cc3)cc2)cs1

HCID59759354

未命名化合物

PRODUCTS

生成物

结构：CC(C)(Sc1nc(COCc2ccc(-c3ccc(C(F)(F)F)cc3)cc2)cs1)C(=O)O

HCID11691259

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-213416fb3d6b4614a90f1d09a3def80f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([C:7]([CH3:8])([S:9][c:10]1[s:11][cH:12][c:13]([CH2:15][O:16][CH2:17][c:18]2[cH:19][cH:20][c:21](-[c:24]3[cH:25][cH:26][c:27]([C:30]([F:31])([F:32])[F:33])[cH:28][cH:29]3)[cH:22][cH:23]2)[n:14]1)[CH3:34])=[O:35].[Cl:43][CH2:44][Cl:45].[OH:36][C:37]([C:38]([F:39])([F:40])[F:41])=[O:42]>>[O:5]=[C:6]([C:7]([CH3:8])([S:9][c:10]1[s:11][cH:12][c:13]([CH2:15][O:16][CH2:17][c:18]2[cH:19][cH:20][c:21](-[c:24]3[cH:25][cH:26][c:27]([C:30]([F:31])([F:32])[F:33])[cH:28][cH:29]3)[cH:22][cH:23]2)[n:14]1)[CH3:34])[OH:35]