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

Systemtic Name: 5-[2-tert-butyl-6-(hydroxymethyl)-5-methyl-pyridin-3-yl]sulfanyl-2-[2-(4-fluorophenyl)ethyl]-6-oxidanyl-2-propan-2-yl-3H-pyran-4-one Openeye Name: 5-[[2-tert-butyl-6-(hydroxymethyl)-5-methyl-3-pyridyl]sulfanyl]-2-[2-(4-fluorophenyl)ethyl]-6-hydroxy-2-isopropyl-3H-pyran-4-one CAS Name: 5-[[2-tert-butyl-6-(hydroxymethyl)-5-methyl-3-pyridinyl]thio]-2-[2-(4-fluorophenyl)ethyl]-6-hydroxy-2-propan-2-yl-3H-pyran-4-one IUPAC Name: 5-[2-tert-butyl-6-(hydroxymethyl)-5-methylpyridin-3-yl]sulfanyl-2-[2-(4-fluorophenyl)ethyl]-6-hydroxy-2-propan-2-yl-3H-pyran-4-one Traditional Name: 5-[(2-tert-butyl-5-methyl-6-methylol-3-pyridyl)thio]-2-[2-(4-fluorophenyl)ethyl]-6-hydroxy-2-isopropyl-3H-pyran-4-one Formula: C27H34FNO4S MolecularWeight: 487.626563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H34FNO4S/c1-16(2)27(12-11-18-7-9-19(28)10-8-18)14-21(31)23(25(32)33-27)34-22-13-17(3)20(15-30)29-24(22)26(4,5)6/h7-10,13,16,30,32H,11-12,14-15H2,1-6H3