3-bromanyl-N-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-N-pyridin-3-yl-benzenesulfonamide

Systemtic Name: 3-bromanyl-N-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-N-pyridin-3-yl-benzenesulfonamide Openeye Name: 3-bromo-N-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]-N-(3-pyridyl)benzenesulfonamide CAS Name: 3-bromo-N-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-N-(3-pyridinyl)benzenesulfonamide IUPAC Name: 3-bromo-N-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-N-pyridin-3-ylbenzenesulfonamide Traditional Name: 3-bromo-N-(3,5-ditert-butyl-4-hydroxy-benzyl)-N-(3-pyridyl)benzenesulfonamide Formula: C26H31BrN2O3S MolecularWeight: 531.50494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN(C2=CN=CC=C2)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN(C2=CN=CC=C2)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C26H31BrN2O3S/c1-25(2,3)22-13-18(14-23(24(22)30)26(4,5)6)17-29(20-10-8-12-28-16-20)33(31,32)21-11-7-9-19(27)15-21/h7-16,30H,17H2,1-6H3