HRID804021

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3283

Diethyl Ether

C4H10O

HCID8857

Ethyl acetate

C4H8O2

HCID2757925

2-Chloro-1-(thiophen-2-yl)ethan-1-one

C6H5ClOS

反应SMILES：O=C(OC1CN2CCC1CC2)C(NCc1ccc(F)cc1)c1ccccc1

HCID67425657

未命名化合物

PRODUCTS

产物

HCID312

Chloride

Cl-

反应SMILES：O=C(C[N+]12CCC(CC1)C(OC(=O)C(NCc1ccc(F)cc1)c1ccccc1)C2)c1cccs1

HCID178521172

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-aa1c487255e049829e653e0f00c8ceaf
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应SMILES

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