N-[4-(2-adamantyl)phenyl]-4-methylsulfanyl-benzenesulfonamide

Systemtic Name: N-[4-(2-adamantyl)phenyl]-4-methylsulfanyl-benzenesulfonamide Openeye Name: N-[4-(2-adamantyl)phenyl]-4-methylsulfanyl-benzenesulfonamide CAS Name: N-[4-(2-adamantyl)phenyl]-4-(methylthio)benzenesulfonamide IUPAC Name: N-[4-(2-adamantyl)phenyl]-4-methylsulfanylbenzenesulfonamide Traditional Name: N-[4-(2-adamantyl)phenyl]-4-(methylthio)benzenesulfonamide Formula: C23H27NO2S2 MolecularWeight: 413.59598

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3C4CC5CC(C4)CC3C5

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C23H27NO2S2/c1-27-21-6-8-22(9-7-21)28(25,26)24-20-4-2-17(3-5-20)23-18-11-15-10-16(13-18)14-19(23)12-15/h2-9,15-16,18-19,23-24H,10-14H2,1H3