5-[2-tert-butyl-6-(hydroxymethyl)-5-methyl-pyridin-3-yl]sulfanyl-6-oxidanyl-2-propan-2-yl-2-(2-thiophen-3-ylethyl)-3H-pyran-4-one

Systemtic Name: 5-[2-tert-butyl-6-(hydroxymethyl)-5-methyl-pyridin-3-yl]sulfanyl-6-oxidanyl-2-propan-2-yl-2-(2-thiophen-3-ylethyl)-3H-pyran-4-one Openeye Name: 5-[[2-tert-butyl-6-(hydroxymethyl)-5-methyl-3-pyridyl]sulfanyl]-6-hydroxy-2-isopropyl-2-[2-(3-thienyl)ethyl]-3H-pyran-4-one CAS Name: 5-[[2-tert-butyl-6-(hydroxymethyl)-5-methyl-3-pyridinyl]thio]-6-hydroxy-2-propan-2-yl-2-[2-(3-thiophenyl)ethyl]-3H-pyran-4-one IUPAC Name: 5-[2-tert-butyl-6-(hydroxymethyl)-5-methylpyridin-3-yl]sulfanyl-6-hydroxy-2-propan-2-yl-2-(2-thiophen-3-ylethyl)-3H-pyran-4-one Traditional Name: 5-[(2-tert-butyl-5-methyl-6-methylol-3-pyridyl)thio]-6-hydroxy-2-isopropyl-2-[2-(3-thienyl)ethyl]-3H-pyran-4-one Formula: C25H33NO4S2 MolecularWeight: 475.66382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N=C1CO)C(C)(C)C)SC2=C(OC(CC2=O)(CCC3=CSC=C3)C(C)C)O

Isomeric SMILES

CC1=CC(=C(N=C1CO)C(C)(C)C)SC2=C(OC(CC2=O)(CCC3=CSC=C3)C(C)C)O

InChI

InChI=1S/C25H33NO4S2/c1-15(2)25(9-7-17-8-10-31-14-17)12-19(28)21(23(29)30-25)32-20-11-16(3)18(13-27)26-22(20)24(4,5)6/h8,10-11,14-15,27,29H,7,9,12-13H2,1-6H3