HRID281723

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID16794

Isocyanic acid, (alpha,alpha,alpha-trifluoro-o-tolyl) ester

C8H4F3NO

HCID22244730

未命名化合物

PRODUCTS

生成物

结构：COc1cc(CC(=O)OC(C)(C)C)ccc1NC(=O)Nc1ccccc1C(F)(F)F

HCID23512196

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-917b5a1d85e741e8b456bfbb311ef2da
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

[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[F:25][C:26]([c:27]1[c:28]([N:33]=[C:34]=[O:35])[cH:29][cH:30][cH:31][cH:32]1)([F:36])[F:37].[NH2:1][c:2]1[c:3]([O:16][CH3:17])[cH:4][c:5]([CH2:8][C:9](=[O:10])[O:11][C:12]([CH3:13])([CH3:14])[CH3:15])[cH:6][cH:7]1>>[NH:1]([c:2]1[c:3]([O:16][CH3:17])[cH:4][c:5]([CH2:8][C:9](=[O:10])[O:11][C:12]([CH3:13])([CH3:14])[CH3:15])[cH:6][cH:7]1)[C:34]([NH:33][c:28]1[c:27]([C:26]([F:25])([F:36])[F:37])[cH:32][cH:31][cH:30][cH:29]1)=[O:35]