4-[5-(3,5-ditert-butylphenyl)-1,2,4-oxadiazol-3-yl]benzenesulfonamide

Systemtic Name: 4-[5-(3,5-ditert-butylphenyl)-1,2,4-oxadiazol-3-yl]benzenesulfonamide Openeye Name: 4-[5-(3,5-ditert-butylphenyl)-1,2,4-oxadiazol-3-yl]benzenesulfonamide CAS Name: 4-[5-(3,5-ditert-butylphenyl)-1,2,4-oxadiazol-3-yl]benzenesulfonamide IUPAC Name: 4-[5-(3,5-ditert-butylphenyl)-1,2,4-oxadiazol-3-yl]benzenesulfonamide Traditional Name: 4-[5-(3,5-ditert-butylphenyl)-1,2,4-oxadiazol-3-yl]benzenesulfonamide Formula: C22H27N3O3S MolecularWeight: 413.53308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C2=NC(=NO2)C3=CC=C(C=C3)S(=O)(=O)N)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C2=NC(=NO2)C3=CC=C(C=C3)S(=O)(=O)N)C(C)(C)C

InChI

InChI=1S/C22H27N3O3S/c1-21(2,3)16-11-15(12-17(13-16)22(4,5)6)20-24-19(25-28-20)14-7-9-18(10-8-14)29(23,26)27/h7-13H,1-6H3,(H2,23,26,27)