N-[(2-fluorophenyl)methyl]-2-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-cyclohexane-1-carboxamide

Systemtic Name: N-[(2-fluorophenyl)methyl]-2-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-cyclohexane-1-carboxamide Openeye Name: N-[(2-fluorophenyl)methyl]-2-[4-(2-pyridyl)piperazine-1-carbonyl]cyclohexanecarboxamide CAS Name: N-[(2-fluorophenyl)methyl]-2-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-1-cyclohexanecarboxamide IUPAC Name: N-[(2-fluorophenyl)methyl]-2-(4-pyridin-2-ylpiperazine-1-carbonyl)cyclohexane-1-carboxamide Traditional Name: N-(2-fluorobenzyl)-2-[4-(2-pyridyl)piperazine-1-carbonyl]cyclohexanecarboxamide Formula: C24H29FN4O2 MolecularWeight: 424.511063

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NCC2=CC=CC=C2F)C(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C1CCC(C(C1)C(=O)NCC2=CC=CC=C2F)C(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C24H29FN4O2/c25-21-10-4-1-7-18(21)17-27-23(30)19-8-2-3-9-20(19)24(31)29-15-13-28(14-16-29)22-11-5-6-12-26-22/h1,4-7,10-12,19-20H,2-3,8-9,13-17H2,(H,27,30)