3-(1-adamantyl)-5-bromanyl-N-(2-chloranyl-4-cyano-phenyl)-2-oxidanyl-benzenesulfonamide

Systemtic Name: 3-(1-adamantyl)-5-bromanyl-N-(2-chloranyl-4-cyano-phenyl)-2-oxidanyl-benzenesulfonamide Openeye Name: 3-(1-adamantyl)-5-bromo-N-(2-chloro-4-cyano-phenyl)-2-hydroxy-benzenesulfonamide CAS Name: 3-(1-adamantyl)-5-bromo-N-(2-chloro-4-cyanophenyl)-2-hydroxybenzenesulfonamide IUPAC Name: 3-(1-adamantyl)-5-bromo-N-(2-chloro-4-cyanophenyl)-2-hydroxybenzenesulfonamide Traditional Name: 3-(1-adamantyl)-5-bromo-N-(2-chloro-4-cyano-phenyl)-2-hydroxy-benzenesulfonamide Formula: C23H22BrClN2O3S MolecularWeight: 521.85438

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC(=CC(=C4O)S(=O)(=O)NC5=C(C=C(C=C5)C#N)Cl)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC(=CC(=C4O)S(=O)(=O)NC5=C(C=C(C=C5)C#N)Cl)Br

InChI

InChI=1S/C23H22BrClN2O3S/c24-17-7-18(23-9-14-3-15(10-23)5-16(4-14)11-23)22(28)21(8-17)31(29,30)27-20-2-1-13(12-26)6-19(20)25/h1-2,6-8,14-16,27-28H,3-5,9-11H2