5-fluoranyl-2-methyl-N-[(3S)-2-oxidanylideneazepan-3-yl]-N-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]benzenesulfonamide

Systemtic Name: 5-fluoranyl-2-methyl-N-[(3S)-2-oxidanylideneazepan-3-yl]-N-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]benzenesulfonamide Openeye Name: 5-fluoro-2-methyl-N-[(3S)-2-oxoazepan-3-yl]-N-[[4-(2-pyridylmethoxy)phenyl]methyl]benzenesulfonamide CAS Name: 5-fluoro-2-methyl-N-[(3S)-2-oxo-3-azepanyl]-N-[[4-(2-pyridinylmethoxy)phenyl]methyl]benzenesulfonamide IUPAC Name: 5-fluoro-2-methyl-N-[(3S)-2-oxoazepan-3-yl]-N-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]benzenesulfonamide Traditional Name: 5-fluoro-N-[(3S)-2-ketoazepan-3-yl]-2-methyl-N-[4-(2-pyridylmethoxy)benzyl]benzenesulfonamide Formula: C26H28FN3O4S MolecularWeight: 497.581623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)S(=O)(=O)N(CC2=CC=C(C=C2)OCC3=CC=CC=N3)C4CCCCNC4=O

Isomeric SMILES

CC1=C(C=C(C=C1)F)S(=O)(=O)N(CC2=CC=C(C=C2)OCC3=CC=CC=N3)[C@H]4CCCCNC4=O

InChI

InChI=1S/C26H28FN3O4S/c1-19-8-11-21(27)16-25(19)35(32,33)30(24-7-3-5-15-29-26(24)31)17-20-9-12-23(13-10-20)34-18-22-6-2-4-14-28-22/h2,4,6,8-14,16,24H,3,5,7,15,17-18H2,1H3,(H,29,31)/t24-/m0/s1