N-[[3-[3-fluoranyl-4-[4-[4-(4-pyridin-2-ylpiperazin-1-yl)butanoyl]piperazin-1-yl]phenyl]-4,5-dihydro-1,2-oxazol-5-yl]methyl]ethanamide

Systemtic Name: N-[[3-[3-fluoranyl-4-[4-[4-(4-pyridin-2-ylpiperazin-1-yl)butanoyl]piperazin-1-yl]phenyl]-4,5-dihydro-1,2-oxazol-5-yl]methyl]ethanamide Openeye Name: N-[[3-[3-fluoro-4-[4-[4-[4-(2-pyridyl)piperazin-1-yl]butanoyl]piperazin-1-yl]phenyl]-4,5-dihydroisoxazol-5-yl]methyl]acetamide CAS Name: N-[[3-[3-fluoro-4-[4-[1-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-1-piperazinyl]phenyl]-4,5-dihydroisoxazol-5-yl]methyl]acetamide IUPAC Name: N-[[3-[3-fluoro-4-[4-[4-(4-pyridin-2-ylpiperazin-1-yl)butanoyl]piperazin-1-yl]phenyl]-4,5-dihydro-1,2-oxazol-5-yl]methyl]acetamide Traditional Name: N-[[3-[3-fluoro-4-[4-[4-[4-(2-pyridyl)piperazino]butanoyl]piperazino]phenyl]-2-isoxazolin-5-yl]methyl]acetamide Formula: C29H38FN7O3 MolecularWeight: 551.655523

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1CC(=NO1)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)CCCN4CCN(CC4)C5=CC=CC=N5)F

Isomeric SMILES

CC(=O)NCC1CC(=NO1)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)CCCN4CCN(CC4)C5=CC=CC=N5)F

InChI

InChI=1S/C29H38FN7O3/c1-22(38)32-21-24-20-26(33-40-24)23-7-8-27(25(30)19-23)35-15-17-37(18-16-35)29(39)6-4-10-34-11-13-36(14-12-34)28-5-2-3-9-31-28/h2-3,5,7-9,19,24H,4,6,10-18,20-21H2,1H3,(H,32,38)