4-fluoranyl-N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide Openeye Name: 4-fluoro-N-[3-methyl-5-[2-(4-pyridylamino)ethoxy]phenyl]benzenesulfonamide CAS Name: 4-fluoro-N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide Traditional Name: 4-fluoro-N-[3-methyl-5-[2-(4-pyridylamino)ethoxy]phenyl]benzenesulfonamide Formula: C20H20FN3O3S MolecularWeight: 401.454503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCNC2=CC=NC=C2)NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=CC(=C1)OCCNC2=CC=NC=C2)NS(=O)(=O)C3=CC=C(C=C3)F

InChI

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