HRID167837

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2778137

1-(4-Chloro-3-(trifluoromethyl)phenyl)piperazine

C11H12ClF3N2

结构：O=C(NCC(F)(F)F)C1(CCCCBr)c2ccccc2-c2ccccc21

HCID10526437

9-(4-Bromobutyl)-N-(2,2,2-trifluoroethyl)-9H-fluorene-9-carboxamide

C20H19BrF3NO

PRODUCTS

生成物

结构：O=C(NCC(F)(F)F)C1(CCCCN2CCN(c3ccc(Cl)c(C(F)(F)F)c3)CC2)c2ccccc2-c2ccccc21

HCID22640110

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6ec36fe88353478c94e57972c49178ce
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

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