HRID179318

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID23938

Palladium

2 次

HCID95417

1,5-Diphenyl-1,4-pentadien-3-one

C17H14O

3 次

HCID335177

未命名化合物

HCID20696625

2-Chloro-1,7-naphthyridine

C8H5ClN2

PRODUCTS

生成物

结构：CC(C)(C)c1ccc(NC(=O)c2ccccc2Nc2ccc3ccncc3n2)cc1

HCID59017446

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7a05040b462f45a6be13520f2337393c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[Cl:21][c:22]1[n:23][c:24]2[cH:25][n:26][cH:27][cH:28][c:29]2[cH:30][cH:31]1.[NH2:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][c:7]2[cH:8][cH:9][c:10]([C:13]([CH3:14])([CH3:15])[CH3:16])[cH:11][cH:12]2)[cH:17][cH:18][cH:19][cH:20]1.[O:34]=[C:35]([CH:36]=[CH:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1)[CH:44]=[CH:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[O:52]=[C:53]([CH:54]=[CH:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1)[CH:62]=[CH:63][c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1.[O:70]=[C:71]([CH:72]=[CH:73][c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1)[CH:80]=[CH:81][c:82]1[cH:83][cH:84][cH:85][cH:86][cH:87]1.[Pd:32].[Pd:33]>>[NH:1]([c:2]1[c:3]([C:4](=[O:5])[NH:6][c:7]2[cH:8][cH:9][c:10]([C:13]([CH3:14])([CH3:15])[CH3:16])[cH:11][cH:12]2)[cH:17][cH:18][cH:19][cH:20]1)[c:22]1[n:23][c:24]2[cH:25][n:26][cH:27][cH:28][c:29]2[cH:30][cH:31]1