2-oxidanyl-6-phenyl-3-[phenyl-(phenylmethylsulfanyl)methyl]pyran-4-one

Systemtic Name: 2-oxidanyl-6-phenyl-3-[phenyl-(phenylmethylsulfanyl)methyl]pyran-4-one Openeye Name: 3-[benzylsulfanyl(phenyl)methyl]-2-hydroxy-6-phenyl-pyran-4-one CAS Name: 2-hydroxy-6-phenyl-3-[phenyl-(phenylmethylthio)methyl]-4-pyranone IUPAC Name: 3-[benzylsulfanyl(phenyl)methyl]-2-hydroxy-6-phenylpyran-4-one Traditional Name: 3-[(benzylthio)-phenyl-methyl]-2-hydroxy-6-phenyl-pyran-4-one Formula: C25H20O3S MolecularWeight: 400.4895

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC(C2=CC=CC=C2)C3=C(OC(=CC3=O)C4=CC=CC=C4)O

Isomeric SMILES

C1=CC=C(C=C1)CSC(C2=CC=CC=C2)C3=C(OC(=CC3=O)C4=CC=CC=C4)O

InChI

InChI=1S/C25H20O3S/c26-21-16-22(19-12-6-2-7-13-19)28-25(27)23(21)24(20-14-8-3-9-15-20)29-17-18-10-4-1-5-11-18/h1-16,24,27H,17H2