HRID85916

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

3 次

HCID6344

Dichloromethane

CH2Cl2

HCID7972

4-Methylmorpholine

C5H11NO

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID2777907

O-tert-butylhydroxylamine

C4H11NO

结构：COc1ccc(S(=O)(=O)N(CC(=O)O)Cc2ccc3ccccc3n2)cc1

HCID22907080

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(S(=O)(=O)N(CC(=O)NOC(C)(C)C)Cc2ccc3ccccc3n2)cc1

HCID22907171

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-49ab5dc77f7c47b8806d304397ccb14b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:47]([CH3:48])([CH3:49])([CH3:50])[O:51][NH2:52].[CH2:65]([Cl:66])[Cl:67].[CH3:2][O:3][c:4]1[cH:5][cH:6][c:7]([S:10](=[O:11])(=[O:12])[N:13]([CH2:14][C:15](=[O:16])[OH:17])[CH2:18][c:19]2[n:20][c:21]3[cH:22][cH:23][cH:24][cH:25][c:26]3[cH:27][cH:28]2)[cH:8][cH:9]1.[CH3:39][N:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1.[CH3:54][N:55]([CH2:56][CH2:57][CH2:58][N:59]=[C:60]=[N:61][CH2:62][CH3:63])[CH3:64].[ClH:1].[ClH:46].[ClH:53].[OH:29][n:30]1[c:31]2[cH:32][cH:33][cH:34][cH:35][c:36]2[n:37][n:38]1>>[CH3:2][O:3][c:4]1[cH:5][cH:6][c:7]([S:10](=[O:11])(=[O:12])[N:13]([CH2:14][C:15](=[O:17])[NH:52][O:51][C:47]([CH3:48])([CH3:49])[CH3:50])[CH2:18][c:19]2[n:20][c:21]3[cH:22][cH:23][cH:24][cH:25][c:26]3[cH:27][cH:28]2)[cH:8][cH:9]1