4-tert-butyl-N-[3-[cyclopropyl-[2-oxidanyl-4-oxidanylidene-6-(1-phenylbutan-2-yl)pyran-3-yl]methyl]phenyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[3-[cyclopropyl-[2-oxidanyl-4-oxidanylidene-6-(1-phenylbutan-2-yl)pyran-3-yl]methyl]phenyl]benzenesulfonamide Openeye Name: N-[3-[[6-(1-benzylpropyl)-2-hydroxy-4-oxo-pyran-3-yl]-cyclopropyl-methyl]phenyl]-4-tert-butyl-benzenesulfonamide CAS Name: 4-tert-butyl-N-[3-[cyclopropyl-[2-hydroxy-4-oxo-6-(1-phenylbutan-2-yl)-3-pyranyl]methyl]phenyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[3-[cyclopropyl-[2-hydroxy-4-oxo-6-(1-phenylbutan-2-yl)pyran-3-yl]methyl]phenyl]benzenesulfonamide Traditional Name: N-[3-[[6-(1-benzylpropyl)-2-hydroxy-4-keto-pyran-3-yl]-cyclopropyl-methyl]phenyl]-4-tert-butyl-benzenesulfonamide Formula: C35H39NO5S MolecularWeight: 585.75286

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC(=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CCC(CC1=CC=CC=C1)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC(=CC=C4)NS(=O)(=O)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C35H39NO5S/c1-5-24(20-23-10-7-6-8-11-23)31-22-30(37)33(34(38)41-31)32(25-14-15-25)26-12-9-13-28(21-26)36-42(39,40)29-18-16-27(17-19-29)35(2,3)4/h6-13,16-19,21-22,24-25,32,36,38H,5,14-15,20H2,1-4H3