4-methyl-N-[3-(6-oxidanyl-4-oxidanylidene-5-phenethylsulfanyl-pyran-2-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[3-(6-oxidanyl-4-oxidanylidene-5-phenethylsulfanyl-pyran-2-yl)phenyl]benzenesulfonamide Openeye Name: N-[3-(6-hydroxy-4-oxo-5-phenethylsulfanyl-pyran-2-yl)phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[3-[6-hydroxy-4-oxo-5-(phenethylthio)-2-pyranyl]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-(6-hydroxy-4-oxo-5-phenethylsulfanylpyran-2-yl)phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[3-[6-hydroxy-4-keto-5-(phenethylthio)pyran-2-yl]phenyl]-4-methyl-benzenesulfonamide Formula: C26H23NO5S2 MolecularWeight: 493.59452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=CC(=O)C(=C(O3)O)SCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=CC(=O)C(=C(O3)O)SCCC4=CC=CC=C4

InChI

InChI=1S/C26H23NO5S2/c1-18-10-12-22(13-11-18)34(30,31)27-21-9-5-8-20(16-21)24-17-23(28)25(26(29)32-24)33-15-14-19-6-3-2-4-7-19/h2-13,16-17,27,29H,14-15H2,1H3