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

Systemtic Name: N-[5-tert-butyl-4-[[2-[2-(4-hydroxyphenyl)ethyl]-2-methyl-6-oxidanyl-4-oxidanylidene-3H-pyran-5-yl]sulfanyl]-2-methyl-phenyl]thiophene-2-sulfonamide Openeye Name: N-[5-tert-butyl-4-[[6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-oxo-3H-pyran-5-yl]sulfanyl]-2-methyl-phenyl]thiophene-2-sulfonamide CAS Name: N-[5-tert-butyl-4-[[6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-oxo-3H-pyran-5-yl]thio]-2-methylphenyl]-2-thiophenesulfonamide IUPAC Name: N-[5-tert-butyl-4-[[6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-oxo-3H-pyran-5-yl]sulfanyl]-2-methylphenyl]thiophene-2-sulfonamide Traditional Name: N-[5-tert-butyl-4-[[6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-4-keto-2-methyl-3H-pyran-5-yl]thio]-2-methyl-phenyl]thiophene-2-sulfonamide Formula: C29H33NO6S3 MolecularWeight: 587.77042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)SC2=C(OC(CC2=O)(C)CCC3=CC=C(C=C3)O)O)C(C)(C)C)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(C=C(C(=C1)SC2=C(OC(CC2=O)(C)CCC3=CC=C(C=C3)O)O)C(C)(C)C)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C29H33NO6S3/c1-18-15-24(21(28(2,3)4)16-22(18)30-39(34,35)25-7-6-14-37-25)38-26-23(32)17-29(5,36-27(26)33)13-12-19-8-10-20(31)11-9-19/h6-11,14-16,30-31,33H,12-13,17H2,1-5H3