HRID666243

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID13831

Tributylphosphine

C12H27P

HCID18526219

{2-[3-Fluoro-4-(trifluoromethyl)phenyl]-4-methyl-1,3-thiazol-5-yl}methanol

C12H9F4NOS

HCID69283069

tert-Butyl (6-hydroxy-1H-indol-1-yl)acetate

C14H17NO3

PRODUCTS

生成物

结构：Cc1nc(-c2ccc(C(F)(F)F)c(F)c2)sc1COc1ccc2ccn(CC(=O)OC(C)(C)C)c2c1

HCID11156660

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-524f7132454f4d659e9a4316912f0874
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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