N-[3-(4,5-diphenyl-1-propyl-imidazol-2-yl)sulfanylpropyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3-(4,5-diphenyl-1-propyl-imidazol-2-yl)sulfanylpropyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[3-(4,5-diphenyl-1-propyl-imidazol-2-yl)sulfanylpropyl]-4-fluoro-benzenesulfonamide CAS Name: N-[3-[(4,5-diphenyl-1-propyl-2-imidazolyl)thio]propyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[3-(4,5-diphenyl-1-propylimidazol-2-yl)sulfanylpropyl]-4-fluorobenzenesulfonamide Traditional Name: N-[3-[(4,5-diphenyl-1-propyl-imidazol-2-yl)thio]propyl]-4-fluoro-benzenesulfonamide Formula: C27H28FN3O2S2 MolecularWeight: 509.658523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(N=C1SCCCNS(=O)(=O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=C(N=C1SCCCNS(=O)(=O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H28FN3O2S2/c1-2-19-31-26(22-12-7-4-8-13-22)25(21-10-5-3-6-11-21)30-27(31)34-20-9-18-29-35(32,33)24-16-14-23(28)15-17-24/h3-8,10-17,29H,2,9,18-20H2,1H3