5-(4-azanyl-2-tert-butyl-5-methyl-phenyl)sulfanyl-2-butyl-2-[2-(4-hydroxyphenyl)ethyl]-6-oxidanyl-3H-pyran-4-one

Systemtic Name: 5-(4-azanyl-2-tert-butyl-5-methyl-phenyl)sulfanyl-2-butyl-2-[2-(4-hydroxyphenyl)ethyl]-6-oxidanyl-3H-pyran-4-one Openeye Name: 5-(4-amino-2-tert-butyl-5-methyl-phenyl)sulfanyl-2-butyl-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-3H-pyran-4-one CAS Name: 5-[(4-amino-2-tert-butyl-5-methylphenyl)thio]-2-butyl-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-3H-pyran-4-one IUPAC Name: 5-(4-amino-2-tert-butyl-5-methylphenyl)sulfanyl-2-butyl-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-3H-pyran-4-one Traditional Name: 5-[(4-amino-2-tert-butyl-5-methyl-phenyl)thio]-2-butyl-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-3H-pyran-4-one Formula: C28H37NO4S MolecularWeight: 483.66268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CC(=O)C(=C(O1)O)SC2=CC(=C(C=C2C(C)(C)C)N)C)CCC3=CC=C(C=C3)O

Isomeric SMILES

CCCCC1(CC(=O)C(=C(O1)O)SC2=CC(=C(C=C2C(C)(C)C)N)C)CCC3=CC=C(C=C3)O

InChI

InChI=1S/C28H37NO4S/c1-6-7-13-28(14-12-19-8-10-20(30)11-9-19)17-23(31)25(26(32)33-28)34-24-15-18(2)22(29)16-21(24)27(3,4)5/h8-11,15-16,30,32H,6-7,12-14,17,29H2,1-5H3