HRID1554320

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2760632

o-tolyl-acetyl chloride

C9H9ClO

结构：CC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CC(=O)c1ccc(N)cc1

HCID68468184

未命名化合物

PRODUCTS

生成物

结构：CC1=NC(c2ccccc2)(c2ccccc2)C(=O)N1CC(=O)c1ccc(NC(=O)Cc2ccccc2C)cc1

HCID68464130

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-160259f6899a42b4a6de54a710ce2ede
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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