HRID1116328

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID8857

Ethyl Acetate

C4H8O2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID420841

o-Allylhydroxylamine

C3H7NO

HCID18333730

未命名化合物

PRODUCTS

产物

HCID54442552

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-5fbe57ba4d0d46d28e05addc8d4d49db
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应SMILES

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