HRID309838

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6318

4-Chlorobenzoic acid

C7H5ClO2

HCID8471

Triethylamine

C6H15N

HCID66974102

2(1H)-Pyridinone, 1-[4-[4-(aminomethyl)-1H-imidazol-1-yl]phenyl]-

C15H14N4O

PRODUCTS

生成物

结构：O=C(NCc1cn(-c2ccc(-n3ccccc3=O)cc2)cn1)c1ccc(Cl)cc1

HCID24987257

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-97e5940817dd4bc58a9cc8f717bc6f0b
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

[CH3:11][CH2:12][N:13]([CH2:14][CH3:15])[CH2:16][CH3:17].[ClH:18].[NH2:19][CH2:20][c:21]1[n:22][cH:23][n:24](-[c:26]2[cH:27][cH:28][c:29](-[n:32]3[c:33](=[O:38])[cH:34][cH:35][cH:36][cH:37]3)[cH:30][cH:31]2)[cH:25]1.[O:39]=[CH:40][N:41]([CH3:42])[CH3:43].[OH:1][C:2](=[O:3])[c:4]1[cH:5][cH:6][c:7]([Cl:8])[cH:9][cH:10]1>>[C:2](=[O:3])([c:4]1[cH:5][cH:6][c:7]([Cl:8])[cH:9][cH:10]1)[NH:19][CH2:20][c:21]1[n:22][cH:23][n:24](-[c:26]2[cH:27][cH:28][c:29](-[n:32]3[c:33](=[O:38])[cH:34][cH:35][cH:36][cH:37]3)[cH:30][cH:31]2)[cH:25]1