2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-6-[4-(pyridin-4-ylmethoxy)phenyl]pyran-4-one

Systemtic Name: 2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-6-[4-(pyridin-4-ylmethoxy)phenyl]pyran-4-one Openeye Name: 2-hydroxy-3-(2-isopropylphenyl)sulfanyl-6-[4-(4-pyridylmethoxy)phenyl]pyran-4-one CAS Name: 2-hydroxy-3-[(2-propan-2-ylphenyl)thio]-6-[4-(pyridin-4-ylmethoxy)phenyl]-4-pyranone IUPAC Name: 2-hydroxy-3-(2-propan-2-ylphenyl)sulfanyl-6-[4-(pyridin-4-ylmethoxy)phenyl]pyran-4-one Traditional Name: 2-hydroxy-3-(o-cumenylthio)-6-[4-(4-pyridylmethoxy)phenyl]pyran-4-one Formula: C26H23NO4S MolecularWeight: 445.53012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3=CC=C(C=C3)OCC4=CC=NC=C4)O

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3=CC=C(C=C3)OCC4=CC=NC=C4)O

InChI

InChI=1S/C26H23NO4S/c1-17(2)21-5-3-4-6-24(21)32-25-22(28)15-23(31-26(25)29)19-7-9-20(10-8-19)30-16-18-11-13-27-14-12-18/h3-15,17,29H,16H2,1-2H3