HRID810697

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID4641409

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

C10H15N6O+

HCID59451392

未命名化合物

HCID68483605

未命名化合物

PRODUCTS

生成物

结构：N#Cc1cc(Cl)cc(Oc2c(Cl)ccc(CNC(=O)c3[nH]c(C(=O)NC4CC4)cc3Cl)c2F)c1

HCID59451618

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9f1f622ea3c44941840e0db81a3ebb6d
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH:60]([N:61]([CH2:62][CH3:63])[CH:64]([CH3:65])[CH3:66])([CH3:67])[CH3:68].[Cl:25][c:26]1[c:27]([C:37](=[O:38])[OH:39])[nH:28][c:29]([C:31](=[O:32])[NH:33][CH:34]2[CH2:35][CH2:36]2)[cH:30]1.[NH2:40][CH2:41][c:42]1[c:43]([F:59])[c:44]([O:49][c:50]2[cH:51][c:52]([C:53]#[N:54])[cH:55][c:56]([Cl:58])[cH:57]2)[c:45]([Cl:48])[cH:46][cH:47]1.[O:69]=[CH:70][N:71]([CH3:72])[CH3:73].[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[n:8]1([O:9][C:10]([N:11]([CH3:12])[CH3:13])=[N+:14]([CH3:15])[CH3:16])[c:17]2[n:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1>>[Cl:25][c:26]1[c:27]([C:37](=[O:39])[NH:40][CH2:41][c:42]2[c:43]([F:59])[c:44]([O:49][c:50]3[cH:51][c:52]([C:53]#[N:54])[cH:55][c:56]([Cl:58])[cH:57]3)[c:45]([Cl:48])[cH:46][cH:47]2)[nH:28][c:29]([C:31](=[O:32])[NH:33][CH:34]2[CH2:35][CH2:36]2)[cH:30]1