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

Systemtic Name: N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]-2-oxidanyl-benzenesulfonamide Openeye Name: 2-hydroxy-N-[3-methyl-5-[2-(4-pyridylamino)ethoxy]phenyl]benzenesulfonamide CAS Name: 2-hydroxy-N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide IUPAC Name: 2-hydroxy-N-[3-methyl-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide Traditional Name: 2-hydroxy-N-[3-methyl-5-[2-(4-pyridylamino)ethoxy]phenyl]benzenesulfonamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCNC2=CC=NC=C2)NS(=O)(=O)C3=CC=CC=C3O

Isomeric SMILES

CC1=CC(=CC(=C1)OCCNC2=CC=NC=C2)NS(=O)(=O)C3=CC=CC=C3O

InChI

InChI=1S/C20H21N3O4S/c1-15-12-17(23-28(25,26)20-5-3-2-4-19(20)24)14-18(13-15)27-11-10-22-16-6-8-21-9-7-16/h2-9,12-14,23-24H,10-11H2,1H3,(H,21,22)