HRID187380

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3998

Mafenide

C7H10N2O2S

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID81531

Diisopropylethylamine

C8H19N

HCID12849335

2-(3-Cyanophenoxy)-3-pyridinecarboxylic acid

C13H8N2O3

PRODUCTS

生成物

结构：N#Cc1cccc(Oc2ncccc2C(=O)NCc2ccc(S(N)(=O)=O)cc2)c1

HCID22612073

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4b7fcbcbb06043b9b5d7e68d6497c07a
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

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