4-fluoranyl-N-methyl-N-[3-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-methyl-N-[3-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide Openeye Name: 4-fluoro-N-methyl-N-[3-[2-(4-pyridylamino)ethoxy]phenyl]benzenesulfonamide CAS Name: 4-fluoro-N-methyl-N-[3-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-methyl-N-[3-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide Traditional Name: 4-fluoro-N-methyl-N-[3-[2-(4-pyridylamino)ethoxy]phenyl]benzenesulfonamide Formula: C20H20FN3O3S MolecularWeight: 401.454503

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC(=CC=C1)OCCNC2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(C1=CC(=CC=C1)OCCNC2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H20FN3O3S/c1-24(28(25,26)20-7-5-16(21)6-8-20)18-3-2-4-19(15-18)27-14-13-23-17-9-11-22-12-10-17/h2-12,15H,13-14H2,1H3,(H,22,23)