HRID1539585

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID26255

Tetrafluoroborate

BF4-

HCID130500

未命名化合物

HCID521913

2-Propanamine, N,N-diethyl-

C7H17N

HCID5223950

1H-Pyrrolo[2,3-b]pyridin-1-amine

C7H7N3

HCID24903633

2-(Pyridin-2-yl)pyrimidine-5-carboxylic acid

C10H7N3O2

PRODUCTS

生成物

结构：O=C(Nn1ccc2cccnc21)c1cnc(-c2ccccn2)nc1

HCID59199957

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c47288c440d34cbeaef784a91895bea2
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

[B-:34]([F:35])([F:36])([F:37])[F:38].[CH2:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])[CH3:8].[CH3:61][CH2:62][O:63][C:64]([CH3:65])=[O:66].[O:56]=[CH:57][N:58]([CH3:59])[CH3:60].[n:24]1([NH2:33])[cH:25][cH:26][c:27]2[c:28]1[n:29][cH:30][cH:31][cH:32]2.[n:39]1([O:40][C:41]([N:42]([CH3:43])[CH3:44])=[N+:45]([CH3:46])[CH3:47])[c:48]2[cH:49][cH:50][cH:51][cH:52][c:53]2[n:54][n:55]1.[n:9]1[c:10](-[c:15]2[n:16][cH:17][c:18]([C:21](=[O:22])[OH:23])[cH:19][n:20]2)[cH:11][cH:12][cH:13][cH:14]1>>[n:9]1[c:10](-[c:15]2[n:16][cH:17][c:18]([C:21](=[O:23])[NH:33][n:24]3[cH:25][cH:26][c:27]4[c:28]3[n:29][cH:30][cH:31][cH:32]4)[cH:19][n:20]2)[cH:11][cH:12][cH:13][cH:14]1