HRID949391

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11401974

5-Amino-3-tert-butyl-1-(2-methylpyridine-5-yl)pyrazole

C13H18N4

结构：O=C(Nc1ccc(Oc2ccnc3[nH]c(=O)cnc23)cc1F)Oc1ccccc1

HCID59588837

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc4[nH]c(=O)cnc34)cc2F)cn1

HCID59588860

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8260b9cf580f4194a7eede142ef2fe84
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:30]([CH3:31])([CH3:32])([CH3:33])[c:34]1[n:35][n:36](-[c:40]2[cH:41][n:42][c:43]([CH3:46])[cH:44][cH:45]2)[c:37]([NH2:39])[cH:38]1.[F:1][c:2]1[c:3]([NH:20][C:21]([O:22][c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)=[O:29])[cH:4][cH:5][c:6]([O:8][c:9]2[cH:10][cH:11][n:12][c:13]3[c:14]2[n:15][cH:16][c:17](=[O:19])[nH:18]3)[cH:7]1>>[F:1][c:2]1[c:3]([NH:20][C:21](=[O:29])[NH:39][c:37]2[n:36](-[c:40]3[cH:41][n:42][c:43]([CH3:46])[cH:44][cH:45]3)[n:35][c:34]([C:30]([CH3:31])([CH3:32])[CH3:33])[cH:38]2)[cH:4][cH:5][c:6]([O:8][c:9]2[cH:10][cH:11][n:12][c:13]3[c:14]2[n:15][cH:16][c:17](=[O:19])[nH:18]3)[cH:7]1