HRID116969

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID26255

Tetrafluoroborate

BF4-

HCID81531

Diisopropylethylamine

C8H19N

HCID130500

未命名化合物

HCID6484228

Thiomorpholine 1,1-dioxide

C4H9NO2S

结构：Cc1onc(-c2cccc(Cl)c2)c1COc1ccc(C(=O)O)cn1

HCID68444859

未命名化合物

PRODUCTS

生成物

结构：Cc1onc(-c2cccc(Cl)c2)c1COc1ccc(C(=O)N2CCS(=O)(=O)CC2)cn1

HCID68934376

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8c7383d9176e4156ac353cc85e53fbbd
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

[CH:47]([N:48]([CH2:49][CH3:50])[CH:51]([CH3:52])[CH3:53])([CH3:54])[CH3:55].[Cl:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][o:10][c:11]([CH3:24])[c:12]2[CH2:13][O:14][c:15]2[n:16][cH:17][c:18]([C:19](=[O:20])[OH:21])[cH:22][cH:23]2)[cH:5][cH:6][cH:7]1.[F:25][B-:26]([F:27])([F:28])[F:29].[O:64]=[CH:65][N:66]([CH3:67])[CH3:68].[S:56]1(=[O:62])(=[O:63])[CH2:57][CH2:58][NH:59][CH2:60][CH2:61]1.[n:30]1([O:31][C:32]([N:33]([CH3:34])[CH3:35])=[N+:36]([CH3:37])[CH3:38])[c:39]2[cH:40][cH:41][cH:42][cH:43][c:44]2[n:45][n:46]1>>[Cl:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][o:10][c:11]([CH3:24])[c:12]2[CH2:13][O:14][c:15]2[n:16][cH:17][c:18]([C:19](=[O:21])[N:59]3[CH2:58][CH2:57][S:56](=[O:62])(=[O:63])[CH2:61][CH2:60]3)[cH:22][cH:23]2)[cH:5][cH:6][cH:7]1