HRID99625

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID83795

1-Acetylpiperazine

C6H12N2O

结构：O=C1c2c(-c3ccccc3)cc(Cl)nc2OCCCN1Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID22179333

未命名化合物

PRODUCTS

生成物

结构：CC(=O)N1CCN(c2cc(-c3ccccc3)c3c(n2)OCCCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C3=O)CC1

HCID22184430

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c6e1abc151624cf3a78a6457a36d1272
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

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