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

Systemtic Name: N-[3-cyano-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide Openeye Name: N-[3-cyano-5-[2-(4-pyridylamino)ethoxy]phenyl]benzenesulfonamide CAS Name: N-[3-cyano-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide IUPAC Name: N-[3-cyano-5-[2-(pyridin-4-ylamino)ethoxy]phenyl]benzenesulfonamide Traditional Name: N-[3-cyano-5-[2-(4-pyridylamino)ethoxy]phenyl]benzenesulfonamide Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC(=C2)C#N)OCCNC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC(=C2)C#N)OCCNC3=CC=NC=C3

InChI

InChI=1S/C20H18N4O3S/c21-15-16-12-18(24-28(25,26)20-4-2-1-3-5-20)14-19(13-16)27-11-10-23-17-6-8-22-9-7-17/h1-9,12-14,24H,10-11H2,(H,22,23)