HRID87923

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID75645

Cyclobutanamine

C4H9N

结构：CC(C)(C)c1nc2cc(S(=O)(=O)Cl)ccc2n1CC1CCOCC1

HCID57937298

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)c1nc2cc(S(=O)(=O)NC3CCC3)ccc2n1CC1CCOCC1

HCID23659302

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-213626bab95146cb99132d673d44c8ce
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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