HRID213905

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID518900

Methyl (4-hydroxyphenyl)acetate

C9H10O3

结构：Cc1ccc(S(=O)(=O)OCCCNC2=C(c3ccccc3)S(=O)(=O)N(C(C)(C)C)C2=O)cc1

HCID86625867

未命名化合物

PRODUCTS

生成物

结构：COC(=O)Cc1ccc(OCCCNC2=C(c3ccccc3)S(=O)(=O)N(C(C)(C)C)C2=O)cc1

HCID11705787

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-010651801c9f40e6b429277adabaa4a4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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