HRID193050

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID313

Hydrochloric Acid

ClH

HCID8058

n-Hexane

C6H14

HCID75297

Isothiocyanatotrimethylsilane

C4H9NSSi

HCID641096

Phenanthridine, 1,2,3,4,7,8,9,10-octahydro-

C13H17N

HCID178418339

未命名化合物

HCID178506821

未命名化合物

PRODUCTS

生成物

HCID12351899

1,2,3,4,7,8,9,10-Octahydrophenanthridine-4-carbothioamide

C14H18N2S

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-63912ab954894616ae9e401236690858
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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