HRID173104

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID679

Dimethyl sulfoxide

C2H6OS

HCID7854

Propionitrile

C3H5N

HCID30165

Iodide ion

I-

HCID81531

Diisopropylethylamine

C8H19N

HCID10514345

未命名化合物

HCID58324401

3-(hydroxymethyl)-6a,7,9,10-tetrahydropyrido[3,2-e][1,4]thiazino[4,3-a]pyrazin-6(5H)-one

C11H13N3O2S

HCID58324512

未命名化合物

PRODUCTS

产物

HCID76760521

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-7c844de837c24e6f98a8ccec7e41511f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

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