6-oxidanyl-2-phenethyl-2-phenyl-5-(3-propan-2-ylpyridin-4-yl)sulfanyl-3H-pyran-4-one

Systemtic Name: 6-oxidanyl-2-phenethyl-2-phenyl-5-(3-propan-2-ylpyridin-4-yl)sulfanyl-3H-pyran-4-one Openeye Name: 6-hydroxy-5-[(3-isopropyl-4-pyridyl)sulfanyl]-2-phenethyl-2-phenyl-3H-pyran-4-one CAS Name: 6-hydroxy-2-phenethyl-2-phenyl-5-[(3-propan-2-yl-4-pyridinyl)thio]-3H-pyran-4-one IUPAC Name: 6-hydroxy-2-phenethyl-2-phenyl-5-(3-propan-2-ylpyridin-4-yl)sulfanyl-3H-pyran-4-one Traditional Name: 6-hydroxy-5-[(3-isopropyl-4-pyridyl)thio]-2-phenethyl-2-phenyl-3H-pyran-4-one Formula: C27H27NO3S MolecularWeight: 445.57318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CN=C1)SC2=C(OC(CC2=O)(CCC3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CC(C)C1=C(C=CN=C1)SC2=C(OC(CC2=O)(CCC3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C27H27NO3S/c1-19(2)22-18-28-16-14-24(22)32-25-23(29)17-27(31-26(25)30,21-11-7-4-8-12-21)15-13-20-9-5-3-6-10-20/h3-12,14,16,18-19,30H,13,15,17H2,1-2H3