HRID281701

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID94429

Triphosgene

C3Cl6O3

HCID2974132

3-tert-Butyl-1-(4-methylphenyl)-1H-pyrazol-5-amine

C14H19N3

HCID57762833

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(-c3c(C(N)=O)[nH]c4ccccc34)cc2)cc1

HCID11555233

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b70ff2e5f93c49babc9491920a34e778
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

[C:39]([CH3:40])([CH3:41])([CH3:42])[c:43]1[cH:44][c:45]([NH2:55])[n:46](-[c:48]2[cH:49][cH:50][c:51]([CH3:54])[cH:52][cH:53]2)[n:47]1.[CH3:13][CH2:14][N:15]([CH2:16][CH3:17])[CH2:18][CH3:19].[Cl:1][C:2]([Cl:3])([O:4][C:5]([O:6][C:7]([Cl:8])([Cl:9])[Cl:10])=[O:11])[Cl:12].[NH2:20][c:21]1[cH:22][cH:23][c:24](-[c:27]2[c:28]([C:36](=[O:37])[NH2:38])[nH:29][c:30]3[cH:31][cH:32][cH:33][cH:34][c:35]23)[cH:25][cH:26]1.[O:56]1[CH2:57][CH2:58][CH2:59][CH2:60]1>>[C:5](=[O:11])([NH:20][c:21]1[cH:22][cH:23][c:24](-[c:27]2[c:28]([C:36](=[O:37])[NH2:38])[nH:29][c:30]3[cH:31][cH:32][cH:33][cH:34][c:35]23)[cH:25][cH:26]1)[NH:55][c:45]1[cH:44][c:43]([C:39]([CH3:40])([CH3:41])[CH3:42])[n:47][n:46]1-[c:48]1[cH:49][cH:50][c:51]([CH3:54])[cH:52][cH:53]1