1-ethyl-2-[4-(4-fluoranyl-2-methoxy-phenyl)piperazin-1-yl]-N-pyridin-2-yl-cyclohexane-1-carboxamide

Systemtic Name: 1-ethyl-2-[4-(4-fluoranyl-2-methoxy-phenyl)piperazin-1-yl]-N-pyridin-2-yl-cyclohexane-1-carboxamide Openeye Name: 1-ethyl-2-[4-(4-fluoro-2-methoxy-phenyl)piperazin-1-yl]-N-(2-pyridyl)cyclohexanecarboxamide CAS Name: 1-ethyl-2-[4-(4-fluoro-2-methoxyphenyl)-1-piperazinyl]-N-(2-pyridinyl)-1-cyclohexanecarboxamide IUPAC Name: 1-ethyl-2-[4-(4-fluoro-2-methoxyphenyl)piperazin-1-yl]-N-pyridin-2-ylcyclohexane-1-carboxamide Traditional Name: 1-ethyl-2-[4-(4-fluoro-2-methoxy-phenyl)piperazino]-N-(2-pyridyl)cyclohexanecarboxamide Formula: C25H33FN4O2 MolecularWeight: 440.553523

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCCC1N2CCN(CC2)C3=C(C=C(C=C3)F)OC)C(=O)NC4=CC=CC=N4

Isomeric SMILES

CCC1(CCCCC1N2CCN(CC2)C3=C(C=C(C=C3)F)OC)C(=O)NC4=CC=CC=N4

InChI

InChI=1S/C25H33FN4O2/c1-3-25(24(31)28-23-9-5-7-13-27-23)12-6-4-8-22(25)30-16-14-29(15-17-30)20-11-10-19(26)18-21(20)32-2/h5,7,9-11,13,18,22H,3-4,6,8,12,14-17H2,1-2H3,(H,27,28,31)