HRID90686

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID2776438

2-Phenyl-5-(trifluoromethyl)oxazole-4-carboxylic acid

C11H6F3NO3

HCID59301378

未命名化合物

PRODUCTS

生成物

结构：CC(C)CCN(C)c1ccc(NC(=O)c2nc(-c3ccccc3)oc2C(F)(F)F)cn1

HCID59301456

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-55e2b1a5d83649d9b386f9e9e33302b2
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

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