HRID92384

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6342

Acetonitrile

C2H3N

HCID8471

Triethylamine

C6H15N

HCID59466367

未命名化合物

HCID59466506

未命名化合物

PRODUCTS

生成物

结构：CC(C(=O)N1CCN(c2ccc(S(=O)(=O)Nc3nccs3)cc2)CC1)n1ccc2c(F)cccc21

HCID76056899

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-efb1f5770e254f988dcacbd0ad2ea50c
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

[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH3:49][C:50]#[N:51].[F:22][c:23]1[c:24]2[cH:25][cH:26][n:27]([CH:32]([C:33](=[O:34])[OH:35])[CH3:36])[c:28]2[cH:29][cH:30][cH:31]1.[N:1]1([c:7]2[cH:8][cH:9][c:10]([S:13](=[O:14])(=[O:15])[NH:16][c:17]3[s:18][cH:19][cH:20][n:21]3)[cH:11][cH:12]2)[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1.[O:44]=[CH:45][N:46]([CH3:47])[CH3:48]>>[N:1]1([c:7]2[cH:8][cH:9][c:10]([S:13](=[O:14])(=[O:15])[NH:16][c:17]3[s:18][cH:19][cH:20][n:21]3)[cH:11][cH:12]2)[CH2:2][CH2:3][N:4]([C:33]([CH:32]([n:27]2[cH:26][cH:25][c:24]3[c:23]([F:22])[cH:31][cH:30][cH:29][c:28]32)[CH3:36])=[O:34])[CH2:5][CH2:6]1