HRID156263

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID702

Ethanol

C2H6O

HCID5359967

Indium

结构：CC1(C)C(=O)NC(=O)N1CCNc1ncc(C(F)(F)F)c(-c2cc3cc([N+](=O)[O-])ccc3s2)n1

HCID60204639

未命名化合物

PRODUCTS

生成物

结构：CC1(C)C(=O)NC(=O)N1CCNc1ncc(C(F)(F)F)c(-c2cc3cc(N)ccc3s2)n1

HCID60204636

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6e920bace5d44ca4921c27204351bd96
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

[CH3:1][C:2]1([CH3:34])[C:3](=[O:33])[NH:4][C:5](=[O:32])[N:6]1[CH2:7][CH2:8][NH:9][c:10]1[n:11][cH:12][c:13]([C:28]([F:29])([F:30])[F:31])[c:14](-[c:16]2[cH:17][c:18]3[c:19]([s:20]2)[cH:21][cH:22][c:23]([N+:25]([O-:26])=[O:27])[cH:24]3)[n:15]1.[CH3:38][CH2:39][OH:40].[Cl-:36].[In:35].[NH4+:37]>>[CH3:1][C:2]1([CH3:34])[C:3](=[O:33])[NH:4][C:5](=[O:32])[N:6]1[CH2:7][CH2:8][NH:9][c:10]1[n:11][cH:12][c:13]([C:28]([F:29])([F:30])[F:31])[c:14](-[c:16]2[cH:17][c:18]3[c:19]([s:20]2)[cH:21][cH:22][c:23]([NH2:25])[cH:24]3)[n:15]1