4-[2-(4-fluorophenyl)ethynyl]-N-[2-(5-oxidanylidenehexanoylsulfamoyl)phenyl]benzamide

Systemtic Name: 4-[2-(4-fluorophenyl)ethynyl]-N-[2-(5-oxidanylidenehexanoylsulfamoyl)phenyl]benzamide Openeye Name: 4-[2-(4-fluorophenyl)ethynyl]-N-[2-(5-oxohexanoylsulfamoyl)phenyl]benzamide CAS Name: N-[2-(1,5-dioxohexylsulfamoyl)phenyl]-4-[2-(4-fluorophenyl)ethynyl]benzamide IUPAC Name: 4-[2-(4-fluorophenyl)ethynyl]-N-[2-(5-oxohexanoylsulfamoyl)phenyl]benzamide Traditional Name: 4-[2-(4-fluorophenyl)ethynyl]-N-[2-(5-ketohexanoylsulfamoyl)phenyl]benzamide Formula: C27H23FN2O5S MolecularWeight: 506.545323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCC(=O)NS(=O)(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C#CC3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)CCCC(=O)NS(=O)(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C#CC3=CC=C(C=C3)F

InChI

InChI=1S/C27H23FN2O5S/c1-19(31)5-4-8-26(32)30-36(34,35)25-7-3-2-6-24(25)29-27(33)22-15-11-20(12-16-22)9-10-21-13-17-23(28)18-14-21/h2-3,6-7,11-18H,4-5,8H2,1H3,(H,29,33)(H,30,32)