HRID663748

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID88012

5-Aminoindazole

C7H7N3

HCID410615

2-methylmorpholine

C5H11NO

HCID3239010

未命名化合物

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

PRODUCTS

生成物

结构：O=C(Nc1ccc2[nH]ncc2c1)c1ccccc1NCc1ccncc1

HCID69590332

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-27f13192a91b4501962d9f820e2907f3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:59](=[O:60])([OH:61])[O-:62].[CH3:28][CH:29]1[CH2:30][NH:31][CH2:32][CH2:33][O:34]1.[CH3:64][N:65]([CH3:66])[CH:67]=[O:68].[NH2:18][c:19]1[cH:20][c:21]2[cH:22][n:23][nH:24][c:25]2[cH:26][cH:27]1.[Na+:63].[P-:35]([F:36])([F:37])([F:38])([F:39])([F:40])[F:41].[n:1]1[cH:2][cH:3][c:4]([CH2:7][NH:8][c:9]2[c:10]([C:11](=[O:12])[OH:13])[cH:14][cH:15][cH:16][cH:17]2)[cH:5][cH:6]1.[n:42]1([O:43][C:44]([N:45]([CH3:46])[CH3:47])=[N+:48]([CH3:49])[CH3:50])[c:51]2[n:52][cH:53][cH:54][cH:55][c:56]2[n:57][n:58]1>>[n:1]1[cH:2][cH:3][c:4]([CH2:7][NH:8][c:9]2[c:10]([C:11](=[O:13])[NH:18][c:19]3[cH:20][c:21]4[cH:22][n:23][nH:24][c:25]4[cH:26][cH:27]3)[cH:14][cH:15][cH:16][cH:17]2)[cH:5][cH:6]1