HRID172686

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID16768076

N,N-Dimethyl-1-(piperidin-3-yl)methanamine

C8H18N2

HCID86628351

未命名化合物

PRODUCTS

生成物

结构：Cc1c(-c2ccc(C(=O)N3CCCC(CN(C)C)C3)s2)noc1C(F)(F)F

HCID25211711

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-72222ab519d04124b2b1832e8daf1dd1
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

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