2-[4-chloranyl-2-[3-(2-cyclopentylethynyl)phenyl]carbonyl-phenoxy]-N-(2-methyl-4-sulfamoyl-phenyl)ethanamide

Systemtic Name: 2-[4-chloranyl-2-[3-(2-cyclopentylethynyl)phenyl]carbonyl-phenoxy]-N-(2-methyl-4-sulfamoyl-phenyl)ethanamide Openeye Name: 2-[4-chloro-2-[3-(2-cyclopentylethynyl)benzoyl]phenoxy]-N-(2-methyl-4-sulfamoyl-phenyl)acetamide CAS Name: 2-[4-chloro-2-[[3-(2-cyclopentylethynyl)phenyl]-oxomethyl]phenoxy]-N-(2-methyl-4-sulfamoylphenyl)acetamide IUPAC Name: 2-[4-chloro-2-[3-(2-cyclopentylethynyl)benzoyl]phenoxy]-N-(2-methyl-4-sulfamoylphenyl)acetamide Traditional Name: 2-[4-chloro-2-[3-(2-cyclopentylethynyl)benzoyl]phenoxy]-N-(2-methyl-4-sulfamoyl-phenyl)acetamide Formula: C29H27ClN2O5S MolecularWeight: 551.05308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N)NC(=O)COC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC(=C3)C#CC4CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N)NC(=O)COC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC(=C3)C#CC4CCCC4

InChI

InChI=1S/C29H27ClN2O5S/c1-19-15-24(38(31,35)36)12-13-26(19)32-28(33)18-37-27-14-11-23(30)17-25(27)29(34)22-8-4-7-21(16-22)10-9-20-5-2-3-6-20/h4,7-8,11-17,20H,2-3,5-6,18H2,1H3,(H,32,33)(H2,31,35,36)