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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCC(=O)NS(=O)(=O)C1=CC=CC=C1NC(=O)C2=CC=CC=C2C#CC3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)CCCC(=O)NS(=O)(=O)C1=CC=CC=C1NC(=O)C2=CC=CC=C2C#CC3=CC=C(C=C3)F

InChI

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