4-chloranyl-N-[2-[3-[2-(pyridin-4-ylamino)ethoxy]phenyl]ethyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[2-[3-[2-(pyridin-4-ylamino)ethoxy]phenyl]ethyl]benzenesulfonamide Openeye Name: 4-chloro-N-[2-[3-[2-(4-pyridylamino)ethoxy]phenyl]ethyl]benzenesulfonamide CAS Name: 4-chloro-N-[2-[3-[2-(pyridin-4-ylamino)ethoxy]phenyl]ethyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[2-[3-[2-(pyridin-4-ylamino)ethoxy]phenyl]ethyl]benzenesulfonamide Traditional Name: 4-chloro-N-[2-[3-[2-(4-pyridylamino)ethoxy]phenyl]ethyl]benzenesulfonamide Formula: C21H22ClN3O3S MolecularWeight: 431.93568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCNC2=CC=NC=C2)CCNS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)OCCNC2=CC=NC=C2)CCNS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClN3O3S/c22-18-4-6-21(7-5-18)29(26,27)25-13-8-17-2-1-3-20(16-17)28-15-14-24-19-9-11-23-12-10-19/h1-7,9-12,16,25H,8,13-15H2,(H,23,24)