HRID142153

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl acetate

C4H8O2

HCID82498

4-(4-tert-butylphenoxy)aniline

C16H19NO

HCID308449

5-(Chlorosulfonyl)-2-methylbenzoic acid

C8H7ClO4S

PRODUCTS

生成物

结构：Cc1ccc(S(=O)(=O)Nc2ccc(Oc3ccc(C(C)(C)C)cc3)cc2)cc1C(=O)O

HCID58937040

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-79aa19f391144ee599ee95b983f0b245
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

[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([O:9][c:10]2[cH:11][cH:12][c:13]([NH2:16])[cH:14][cH:15]2)[cH:17][cH:18]1.[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49].[Cl:19][S:20](=[O:21])(=[O:22])[c:23]1[cH:24][cH:25][c:26]([CH3:32])[c:27]([C:28](=[O:29])[OH:30])[cH:31]1.[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[cH:33]1[cH:34][cH:35][n:36][cH:37][cH:38]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([O:9][c:10]2[cH:11][cH:12][c:13]([NH:16][S:20](=[O:21])(=[O:22])[c:23]3[cH:24][cH:25][c:26]([CH3:32])[c:27]([C:28](=[O:29])[OH:30])[cH:31]3)[cH:14][cH:15]2)[cH:17][cH:18]1