HRID107754

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID92259

2,6-Diisopropylphenyl isocyanate

C13H17NO

HCID21957911

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1cccc(C(C)C)c1NC(=O)N(Cc1ccc(N(C)C)cc1)c1ccc(C(F)(F)F)cc1

HCID21957953

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a924ae21267c449eb6b3f6a944a37ee8
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[cH:4][cH:5][c:6]([CH2:9][NH:10][c:11]2[cH:12][cH:13][c:14]([C:17]([F:18])([F:19])[F:20])[cH:15][cH:16]2)[cH:7][cH:8]1)[CH3:21].[CH:22]([CH3:23])([CH3:24])[c:25]1[c:26]([N:34]=[C:35]=[O:36])[c:27]([CH:31]([CH3:32])[CH3:33])[cH:28][cH:29][cH:30]1>>[CH3:1][N:2]([c:3]1[cH:4][cH:5][c:6]([CH2:9][N:10]([c:11]2[cH:12][cH:13][c:14]([C:17]([F:18])([F:19])[F:20])[cH:15][cH:16]2)[C:35]([NH:34][c:26]2[c:25]([CH:22]([CH3:23])[CH3:24])[cH:30][cH:29][cH:28][c:27]2[CH:31]([CH3:32])[CH3:33])=[O:36])[cH:7][cH:8]1)[CH3:21]