N-[5-tert-butyl-4-[[2-cyclopentyl-2-[2-(4-hydroxyphenyl)ethyl]-6-oxidanyl-4-oxidanylidene-3H-pyran-5-yl]sulfanyl]-2-methyl-phenyl]benzenesulfonamide

Systemtic Name: N-[5-tert-butyl-4-[[2-cyclopentyl-2-[2-(4-hydroxyphenyl)ethyl]-6-oxidanyl-4-oxidanylidene-3H-pyran-5-yl]sulfanyl]-2-methyl-phenyl]benzenesulfonamide Openeye Name: N-[5-tert-butyl-4-[[2-cyclopentyl-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-4-oxo-3H-pyran-5-yl]sulfanyl]-2-methyl-phenyl]benzenesulfonamide CAS Name: N-[5-tert-butyl-4-[[2-cyclopentyl-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-4-oxo-3H-pyran-5-yl]thio]-2-methylphenyl]benzenesulfonamide IUPAC Name: N-[5-tert-butyl-4-[[2-cyclopentyl-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-4-oxo-3H-pyran-5-yl]sulfanyl]-2-methylphenyl]benzenesulfonamide Traditional Name: N-[5-tert-butyl-4-[[2-cyclopentyl-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-4-keto-3H-pyran-5-yl]thio]-2-methyl-phenyl]benzenesulfonamide Formula: C35H41NO6S2 MolecularWeight: 635.83314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)SC2=C(OC(CC2=O)(CCC3=CC=C(C=C3)O)C4CCCC4)O)C(C)(C)C)NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=C(C(=C1)SC2=C(OC(CC2=O)(CCC3=CC=C(C=C3)O)C4CCCC4)O)C(C)(C)C)NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C35H41NO6S2/c1-23-20-31(28(34(2,3)4)21-29(23)36-44(40,41)27-12-6-5-7-13-27)43-32-30(38)22-35(42-33(32)39,25-10-8-9-11-25)19-18-24-14-16-26(37)17-15-24/h5-7,12-17,20-21,25,36-37,39H,8-11,18-19,22H2,1-4H3