HRID827851

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID53167

1-Methylpiperazine

C5H12N2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

结构：O=C(Nc1c[nH]nc1-c1nc2c(C(=O)O)cccc2[nH]1)c1c(F)cccc1F

HCID178522445

未命名化合物

PRODUCTS

生成物

结构：CN1CCN(C(=O)c2cccc3[nH]c(-c4n[nH]cc4NC(=O)c4c(F)cccc4F)nc23)CC1

HCID178481037

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-969b527815aa4eaf9a955e4d94c574fb
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:36]([Cl:37])[CH2:38][Cl:39].[CH3:29][N:30]1[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]1.[F:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][c:7]2[c:8](-[c:12]3[n:13][c:14]4[c:15]([nH:16]3)[cH:17][cH:18][cH:19][c:20]4[C:21](=[O:22])[OH:23])[n:9][nH:10][cH:11]2)[c:24]([F:28])[cH:25][cH:26][cH:27]1.[O:50]=[CH:51][N:52]([CH3:53])[CH3:54].[OH:40][n:41]1[c:42]2[c:43]([cH:44][cH:45][cH:46][cH:47]2)[n:48][n:49]1>>[F:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][c:7]2[c:8](-[c:12]3[n:13][c:14]4[c:15]([nH:16]3)[cH:17][cH:18][cH:19][c:20]4[C:21](=[O:22])[N:33]3[CH2:32][CH2:31][N:30]([CH3:29])[CH2:35][CH2:34]3)[n:9][nH:10][cH:11]2)[c:24]([F:28])[cH:25][cH:26][cH:27]1