HRID817018

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID77379

5-Chloro-1H-indole-3-ethylamine

C10H11ClN2

HCID81531

Diisopropylethylamine

C8H19N

HCID4641409

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

C10H15N6O+

HCID24275252

未命名化合物

PRODUCTS

生成物

结构：O=C(NCCc1c[nH]c2ccc(Cl)cc12)C1CCN(c2c(F)cccc2F)C1=O

HCID49868913

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a6dd320056fb4400986824da50e5a7cd
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:56]([N:57]([CH2:58][CH3:59])[CH:60]([CH3:61])[CH3:62])([CH3:63])[CH3:64].[Cl:2][c:3]1[cH:4][c:5]2[c:6]([CH2:12][CH2:13][NH2:14])[cH:7][nH:8][c:9]2[cH:10][cH:11]1.[ClH:1].[F:15][c:16]1[c:17]([N:23]2[C:24](=[O:31])[CH:25]([C:28](=[O:29])[OH:30])[CH2:26][CH2:27]2)[c:18]([F:22])[cH:19][cH:20][cH:21]1.[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[P-:32]([F:33])([F:34])([F:35])([F:36])([F:37])[F:38].[n:39]1([O:40][C:41]([N:42]([CH3:43])[CH3:44])=[N+:45]([CH3:46])[CH3:47])[c:48]2[n:49][cH:50][cH:51][cH:52][c:53]2[n:54][n:55]1>>[Cl:2][c:3]1[cH:4][c:5]2[c:6]([CH2:12][CH2:13][NH:14][C:28]([CH:25]3[C:24](=[O:31])[N:23]([c:17]4[c:16]([F:15])[cH:21][cH:20][cH:19][c:18]4[F:22])[CH2:27][CH2:26]3)=[O:29])[cH:7][nH:8][c:9]2[cH:10][cH:11]1