HRID288695

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID81184

1,8-Diazabicyclo[5.4.0]undec-7-ene

C9H16N2

HCID3034645

pyrrolidine-3-carboxylic acid

C5H9NO2

HCID58374087

2-Bromo-1-(4-(5-(5-phenyl-4-propylisoxazol-3-yl)-1,2,4-oxadiazol-3-yl)phenyl)ethanol

C22H20BrN3O3

PRODUCTS

产物

HCID50925181

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-73fca320a93e4a14b934a9a25bc2cba6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应SMILES

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