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

Systemtic Name: 5-[3-tert-butyl-2-(hydroxymethyl)-6-methyl-pyridin-4-yl]sulfanyl-2-[2-(4-fluorophenyl)ethyl]-6-oxidanyl-2-propan-2-yl-3H-pyran-4-one Openeye Name: 5-[[3-tert-butyl-2-(hydroxymethyl)-6-methyl-4-pyridyl]sulfanyl]-2-[2-(4-fluorophenyl)ethyl]-6-hydroxy-2-isopropyl-3H-pyran-4-one CAS Name: 5-[[3-tert-butyl-2-(hydroxymethyl)-6-methyl-4-pyridinyl]thio]-2-[2-(4-fluorophenyl)ethyl]-6-hydroxy-2-propan-2-yl-3H-pyran-4-one IUPAC Name: 5-[3-tert-butyl-2-(hydroxymethyl)-6-methylpyridin-4-yl]sulfanyl-2-[2-(4-fluorophenyl)ethyl]-6-hydroxy-2-propan-2-yl-3H-pyran-4-one Traditional Name: 5-[(3-tert-butyl-6-methyl-2-methylol-4-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=NC(=C(C(=C1)SC2=C(OC(CC2=O)(CCC3=CC=C(C=C3)F)C(C)C)O)C(C)(C)C)CO

Isomeric SMILES

CC1=NC(=C(C(=C1)SC2=C(OC(CC2=O)(CCC3=CC=C(C=C3)F)C(C)C)O)C(C)(C)C)CO

InChI

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