HRID1236234

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6893

2,3-Xylidine

C8H11N

HCID8471

Triethylamine

C6H15N

结构：O=C(Cl)c1ccc(C(=O)N2Cc3ccccc3Cc3ccccc32)cc1

HCID53802244

未命名化合物

PRODUCTS

生成物

结构：Cc1cccc(NC(=O)c2ccc(C(=O)N3Cc4ccccc4Cc4ccccc43)cc2)c1C

HCID15307992

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1c6b4653487a4c62bc959b3167af186f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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