HRID1557510

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID6228

Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID9886

Hexafluorophosphate ion

F6P-

HCID77379

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

C10H11ClN2

HCID4641409

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

C10H15N6O+

HCID63379544

未命名化合物

PRODUCTS

产物

HCID66832051

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-7a84e3623ffd4b7897e262decc43a09c
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

[CH2:57]1[O:58][CH2:59][CH2:60][CH2:61]1.[Cl:1][c:2]1[cH:3][c:4]([CH2:5][c:6]2[n:7][c:8]([C:11]([O:13][CH2:12][CH3:14])=[O:15])[n:9][o:10]2)[cH:16][cH:17][cH:18]1.[Cl:20][c:21]1[cH:22][c:23]2[c:24]([CH2:30][CH2:31][NH2:32])[cH:25][nH:26][c:27]2[cH:28][cH:29]1.[ClH:19].[Na+:63].[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[OH-:62].[OH2:64].[P-:33]([F:34])([F:35])([F:36])([F:37])([F:38])[F:39].[n:40]1([O:41][C:42]([N:43]([CH3:44])[CH3:45])=[N+:46]([CH3:47])[CH3:48])[c:49]2[n:50][cH:51][cH:52][cH:53][c:54]2[n:55][n:56]1>>[Cl:1][c:2]1[cH:3][c:4]([CH2:5][c:6]2[n:7][c:8]([C:11](=[O:13])[NH:32][CH2:31][CH2:30][c:24]3[c:23]4[cH:22][c:21]([Cl:20])[cH:29][cH:28][c:27]4[nH:26][cH:25]3)[n:9][o:10]2)[cH:16][cH:17][cH:18]1