HRID1230477

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID136524

Cyclopropane-1,2-dicarboxylic acid

C5H6O4

HCID4641409

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

C10H15N6O+

HCID59618313

未命名化合物

PRODUCTS

生成物

结构：O=C(Nc1ccnc(NC(=O)C2CC2C(=O)O)c1)c1c(Cl)cccc1Cl

HCID67128514

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b3a2d3cf59524e2bbfc548e08c630ff1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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