HRID214218

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8739

Carzenide

C7H7NO4S

HCID8857

Ethyl acetate

C4H8O2

HCID70048

Norcyclizine

C17H20N2

PRODUCTS

生成物

结构：NS(=O)(=O)c1ccc(C(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1

HCID19838794

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-eb3002b59ae045dc87ef423f3a014818
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

[Br-:34].[CH3:36][N:37]([CH3:38])[CH:39]=[O:40].[CH3:41][CH2:42][O:43][C:44](=[O:45])[CH3:46].[CH:14]([c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[N:27]1[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]1.[K+:35].[OH2:33].[S:1]([NH2:2])(=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([C:9](=[O:10])[OH:11])[cH:12][cH:13]1>>[S:1]([NH2:2])(=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([C:9](=[O:11])[N:30]2[CH2:29][CH2:28][N:27]([CH:14]([c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[CH2:32][CH2:31]2)[cH:12][cH:13]1