HRID192960

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3699841

4-(4'-Fluorobenzyl)piperidine

C12H16FN

结构：CC(=O)NCCNc1cc(NC(=O)CCl)nc(-c2ccccc2)n1

HCID11256532

未命名化合物

PRODUCTS

生成物

结构：CC(=O)NCCNc1cc(NC(=O)CN2CCC(Cc3ccc(F)cc3)CC2)nc(-c2ccccc2)n1

HCID22379006

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2bf50561c4b1446c85f713d19b6ebc02
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]([CH3:2])(=[O:3])[NH:4][CH2:5][CH2:6][NH:7][c:8]1[cH:9][c:10]([NH:20][C:21]([CH2:22][Cl:23])=[O:24])[n:11][c:12](-[c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[n:13]1.[F:25][c:26]1[cH:27][cH:28][c:29]([CH2:30][CH:31]2[CH2:32][CH2:33][NH:34][CH2:35][CH2:36]2)[cH:37][cH:38]1>>[C:1]([CH3:2])(=[O:3])[NH:4][CH2:5][CH2:6][NH:7][c:8]1[cH:9][c:10]([NH:20][C:21]([CH2:22][N:34]2[CH2:33][CH2:32][CH:31]([CH2:30][c:29]3[cH:28][cH:27][c:26]([F:25])[cH:38][cH:37]3)[CH2:36][CH2:35]2)=[O:24])[n:11][c:12](-[c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[n:13]1