N-[[3-[3-fluoranyl-4-[4-[4-[4-(3-oxidanylpyridin-2-yl)piperazin-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-(3-oxidanylpyridin-2-yl)piperazin-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-(3-hydroxy-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-[4-[4-(3-hydroxy-2-pyridinyl)-1-piperazinyl]-1-oxobutyl]-1-piperazinyl]phenyl]-4,5-dihydroisoxazol-5-yl]methyl]acetamide IUPAC Name: N-[[3-[3-fluoro-4-[4-[4-[4-(3-hydroxypyridin-2-yl)piperazin-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-(3-hydroxy-2-pyridyl)piperazino]butanoyl]piperazino]phenyl]-2-isoxazolin-5-yl]methyl]acetamide Formula: C29H38FN7O4 MolecularWeight: 567.654923

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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=C(C=CC=N5)O)F

Isomeric SMILES

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

InChI

InChI=1S/C29H38FN7O4/c1-21(38)32-20-23-19-25(33-41-23)22-6-7-26(24(30)18-22)35-14-16-36(17-15-35)28(40)5-3-9-34-10-12-37(13-11-34)29-27(39)4-2-8-31-29/h2,4,6-8,18,23,39H,3,5,9-17,19-20H2,1H3,(H,32,38)