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

Systemtic Name: 3-(1-adamantyl)-N-(2-chloranyl-4-cyano-phenyl)-5-methyl-2-oxidanyl-benzenesulfonamide Openeye Name: 3-(1-adamantyl)-N-(2-chloro-4-cyano-phenyl)-2-hydroxy-5-methyl-benzenesulfonamide CAS Name: 3-(1-adamantyl)-N-(2-chloro-4-cyanophenyl)-2-hydroxy-5-methylbenzenesulfonamide IUPAC Name: 3-(1-adamantyl)-N-(2-chloro-4-cyanophenyl)-2-hydroxy-5-methylbenzenesulfonamide Traditional Name: 3-(1-adamantyl)-N-(2-chloro-4-cyano-phenyl)-2-hydroxy-5-methyl-benzenesulfonamide Formula: C24H25ClN2O3S MolecularWeight: 456.9849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C23CC4CC(C2)CC(C4)C3)O)S(=O)(=O)NC5=C(C=C(C=C5)C#N)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)C23CC4CC(C2)CC(C4)C3)O)S(=O)(=O)NC5=C(C=C(C=C5)C#N)Cl

InChI

InChI=1S/C24H25ClN2O3S/c1-14-4-19(24-10-16-6-17(11-24)8-18(7-16)12-24)23(28)22(5-14)31(29,30)27-21-3-2-15(13-26)9-20(21)25/h2-5,9,16-18,27-28H,6-8,10-12H2,1H3