HRID1144410

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8058

n-Hexane

C6H14

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID68489572

未命名化合物

PRODUCTS

生成物

HCID68494893

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-08075aa34cd745458bf51e4f45691da6
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

[C:52]([O:53][CH2:54][CH3:55])(=[O:56])[CH3:57].[CH3:19][CH2:20][N:21]=[C:22]=[N:23][CH2:24][CH2:25][CH2:26][N:27]([CH3:28])[CH3:29].[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:58][CH2:59][CH2:60][CH2:61][CH2:62][CH3:63].[F:1][c:2]1[cH:3][cH:4][c:5]([C:8]([C:9](=[O:10])[OH:11])=[CH:12][c:13]2[s:14][cH:15][c:16]([CH3:18])[cH:17]2)[cH:6][cH:7]1.[O:47]=[CH:48][N:49]([CH3:50])[CH3:51].[OH2:64].[OH:30][n:31]1[c:32]2[c:33]([cH:34][cH:35][cH:36][cH:37]2)[n:38][n:39]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:8]([C:9](=[O:10])[NH2:21])=[CH:12][c:13]2[s:14][cH:15][c:16]([CH3:18])[cH:17]2)[cH:6][cH:7]1