HRID836149

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8078

Cyclohexane

C6H12

HCID15303

Toluene-4-sulphonohydrazide

C7H10N2O2S

HCID31347

Sulfolane

C4H8O2S

HCID498716

未命名化合物

HCID11644978

未命名化合物

PRODUCTS

生成物

HCID11716047

4-(2-methyl-8-azabicyclo[3.2.1]oct-8-yl)naphthalene-1-carbonitrile

C19H20N2

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-74eec08053644674b18755e62b5b9cb1
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

[C:35]([BH3-:36])#[N:37].[CH2:61]1[CH2:62][CH2:63][CH2:64][CH2:65][CH2:66]1.[CH3:1][CH:2]1[CH:3]2[CH2:4][CH2:5][CH:6]([CH2:7][C:8]1=[O:9])[N:10]2[c:11]1[cH:12][cH:13][c:14]([C:21]#[N:22])[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]12.[CH3:57][CH2:58][OH:59].[CH3:67][N:68]([CH3:69])[CH:70]=[O:71].[Na+:38].[OH2:60].[S:39]1(=[O:44])(=[O:45])[CH2:40][CH2:41][CH2:42][CH2:43]1.[c:23]1([CH3:24])[cH:25][cH:26][c:27]([S:28]([NH:29][NH2:30])(=[O:31])=[O:32])[cH:33][cH:34]1.[c:46]1([CH3:47])[cH:48][cH:49][c:50]([S:51]([OH:52])(=[O:53])=[O:54])[cH:55][cH:56]1>>[CH3:1][CH:2]1[CH:3]2[CH2:4][CH2:5][CH:6]([CH2:7][CH2:8]1)[N:10]2[c:11]1[cH:12][cH:13][c:14]([C:21]#[N:22])[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]12