HRID151508

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

结构：COCN(c1cc(Cl)cnc1C(=O)N1c2ccccc2OCC1C)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1

HCID57942091

未命名化合物

PRODUCTS

生成物

结构：CC1COc2ccccc2N1C(=O)c1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1

HCID44177076

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e903034eb34247198d0be7b01a17945a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[Cl:1][c:2]1[c:3]([C:35]([F:36])([F:37])[F:38])[cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]([CH2:12][O:13][CH3:14])[c:15]2[c:16]([C:22](=[O:23])[N:24]3[CH:25]([CH3:34])[CH2:26][O:27][c:28]4[c:29]3[cH:30][cH:31][cH:32][cH:33]4)[n:17][cH:18][c:19]([Cl:21])[cH:20]2)[cH:6][cH:7]1.[ClH:39].[OH2:40]>>[Cl:1][c:2]1[c:3]([C:35]([F:36])([F:37])[F:38])[cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][c:15]2[c:16]([C:22](=[O:23])[N:24]3[CH:25]([CH3:34])[CH2:26][O:27][c:28]4[c:29]3[cH:30][cH:31][cH:32][cH:33]4)[n:17][cH:18][c:19]([Cl:21])[cH:20]2)[cH:6][cH:7]1