HRID305277

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID15718

(p-tert-Butylphenoxy)acetic acid

C12H16O3

HCID70968436

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C(C)NC(=O)COc2ccc(C(C)(C)C)cc2)ccc1NS(C)(=O)=O

HCID21097443

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-82246f3ba15b43c4980347e40f7157c9
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:6]([CH3:7])([CH3:8])([CH3:9])[c:10]1[cH:11][cH:12][c:13]([O:14][CH2:15][C:16](=[O:17])[OH:18])[cH:19][cH:20]1.[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[ClH:21].[NH2:22][CH:23]([CH3:24])[c:25]1[cH:26][c:27]([CH3:36])[c:28]([NH:31][S:32](=[O:33])(=[O:34])[CH3:35])[cH:29][cH:30]1.[O:1]1[CH2:2][CH2:3][CH2:4][CH2:5]1>>[C:6]([CH3:7])([CH3:8])([CH3:9])[c:10]1[cH:11][cH:12][c:13]([O:14][CH2:15][C:16](=[O:18])[NH:22][CH:23]([CH3:24])[c:25]2[cH:26][c:27]([CH3:36])[c:28]([NH:31][S:32](=[O:33])(=[O:34])[CH3:35])[cH:29][cH:30]2)[cH:19][cH:20]1