N-[4-ethyl-2-(3-fluoranylpiperazin-1-yl)phenyl]-2-oxidanyl-benzenesulfonamide

Systemtic Name: N-[4-ethyl-2-(3-fluoranylpiperazin-1-yl)phenyl]-2-oxidanyl-benzenesulfonamide Openeye Name: N-[4-ethyl-2-(3-fluoropiperazin-1-yl)phenyl]-2-hydroxy-benzenesulfonamide CAS Name: N-[4-ethyl-2-(3-fluoro-1-piperazinyl)phenyl]-2-hydroxybenzenesulfonamide IUPAC Name: N-[4-ethyl-2-(3-fluoropiperazin-1-yl)phenyl]-2-hydroxybenzenesulfonamide Traditional Name: N-[4-ethyl-2-(3-fluoropiperazino)phenyl]-2-hydroxy-benzenesulfonamide Formula: C18H22FN3O3S MolecularWeight: 379.448983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC=C2O)N3CCNC(C3)F

Isomeric SMILES

CCC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC=C2O)N3CCNC(C3)F

InChI

InChI=1S/C18H22FN3O3S/c1-2-13-7-8-14(15(11-13)22-10-9-20-18(19)12-22)21-26(24,25)17-6-4-3-5-16(17)23/h3-8,11,18,20-21,23H,2,9-10,12H2,1H3