(2S)-5-[(6-tert-butyl-1H-indol-5-yl)sulfanyl]-2-[2-(4-hydroxyphenyl)ethyl]-6-oxidanyl-2-propan-2-yl-3H-pyran-4-one

Systemtic Name: (2S)-5-[(6-tert-butyl-1H-indol-5-yl)sulfanyl]-2-[2-(4-hydroxyphenyl)ethyl]-6-oxidanyl-2-propan-2-yl-3H-pyran-4-one Openeye Name: (2S)-5-[(6-tert-butyl-1H-indol-5-yl)sulfanyl]-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-isopropyl-3H-pyran-4-one CAS Name: (2S)-5-[(6-tert-butyl-1H-indol-5-yl)thio]-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-propan-2-yl-3H-pyran-4-one IUPAC Name: (2S)-5-[(6-tert-butyl-1H-indol-5-yl)sulfanyl]-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-propan-2-yl-3H-pyran-4-one Traditional Name: (2S)-5-[(6-tert-butyl-1H-indol-5-yl)thio]-6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-isopropyl-3H-pyran-4-one Formula: C28H33NO4S MolecularWeight: 479.63092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CC(=O)C(=C(O1)O)SC2=C(C=C3C(=C2)C=CN3)C(C)(C)C)CCC4=CC=C(C=C4)O

Isomeric SMILES

CC(C)[C@@]1(CC(=O)C(=C(O1)O)SC2=C(C=C3C(=C2)C=CN3)C(C)(C)C)CCC4=CC=C(C=C4)O

InChI

InChI=1S/C28H33NO4S/c1-17(2)28(12-10-18-6-8-20(30)9-7-18)16-23(31)25(26(32)33-28)34-24-14-19-11-13-29-22(19)15-21(24)27(3,4)5/h6-9,11,13-15,17,29-30,32H,10,12,16H2,1-5H3/t28-/m0/s1