HRID2342018

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID262903

6-Fluoroindole-3-carboxaldehyde

C9H6FNO

结构：CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)Cc2nnc(-c3ccccc3)n2-c2cc(F)c(F)cc21

HCID58957934

未命名化合物

PRODUCTS

生成物

结构：CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)C(=Cc2c[nH]c3cc(F)ccc23)c2nnc(-c3ccccc3)n2-c2cc(F)c(F)cc21

HCID136352448

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-caf7661f60ee4d49b53e9ad09a26975a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([C:9]([CH2:10][N:11]1[c:12]2[c:13]([cH:28][c:29]([F:33])[c:30]([F:32])[cH:31]2)-[n:14]2[c:15](-[c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[n:16][n:17][c:18]2[CH2:19][C:20]1=[O:21])=[O:34])[CH:35]([CH3:36])[CH3:37].[F:38][c:39]1[cH:40][cH:41][c:42]2[c:43]([CH:48]=[O:49])[cH:44][nH:45][c:46]2[cH:47]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]([C:9]([CH2:10][N:11]1[c:12]2[c:13]([cH:28][c:29]([F:33])[c:30]([F:32])[cH:31]2)-[n:14]2[c:15](-[c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[n:16][n:17][c:18]2[C:19](=[CH:48][c:43]2[c:42]3[cH:41][cH:40][c:39]([F:38])[cH:47][c:46]3[nH:45][cH:44]2)[C:20]1=[O:21])=[O:34])[CH:35]([CH3:36])[CH3:37]