1-[4-(1-cyclopentylpiperidin-4-yl)oxyphenyl]-N-[(3-fluorophenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: 1-[4-(1-cyclopentylpiperidin-4-yl)oxyphenyl]-N-[(3-fluorophenyl)methyl]pyrazole-4-carboxamide Openeye Name: 1-[4-[(1-cyclopentyl-4-piperidyl)oxy]phenyl]-N-[(3-fluorophenyl)methyl]pyrazole-4-carboxamide CAS Name: 1-[4-[(1-cyclopentyl-4-piperidinyl)oxy]phenyl]-N-[(3-fluorophenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: 1-[4-(1-cyclopentylpiperidin-4-yl)oxyphenyl]-N-[(3-fluorophenyl)methyl]pyrazole-4-carboxamide Traditional Name: 1-[4-[(1-cyclopentyl-4-piperidyl)oxy]phenyl]-N-(3-fluorobenzyl)pyrazole-4-carboxamide Formula: C27H31FN4O2 MolecularWeight: 462.559043

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCC(CC2)OC3=CC=C(C=C3)N4C=C(C=N4)C(=O)NCC5=CC(=CC=C5)F

Isomeric SMILES

C1CCC(C1)N2CCC(CC2)OC3=CC=C(C=C3)N4C=C(C=N4)C(=O)NCC5=CC(=CC=C5)F

InChI

InChI=1S/C27H31FN4O2/c28-22-5-3-4-20(16-22)17-29-27(33)21-18-30-32(19-21)24-8-10-25(11-9-24)34-26-12-14-31(15-13-26)23-6-1-2-7-23/h3-5,8-11,16,18-19,23,26H,1-2,6-7,12-15,17H2,(H,29,33)