5-(6-oxidanyl-4-oxidanylidene-5-phenethylsulfanyl-2-phenyl-3H-pyran-2-yl)pentanamide

Systemtic Name: 5-(6-oxidanyl-4-oxidanylidene-5-phenethylsulfanyl-2-phenyl-3H-pyran-2-yl)pentanamide Openeye Name: 5-(6-hydroxy-4-oxo-5-phenethylsulfanyl-2-phenyl-3H-pyran-2-yl)pentanamide CAS Name: 5-[6-hydroxy-4-oxo-5-(phenethylthio)-2-phenyl-3H-pyran-2-yl]pentanamide IUPAC Name: 5-(6-hydroxy-4-oxo-5-phenethylsulfanyl-2-phenyl-3H-pyran-2-yl)pentanamide Traditional Name: 5-[6-hydroxy-4-keto-5-(phenethylthio)-2-phenyl-3H-pyran-2-yl]valeramide Formula: C24H27NO4S MolecularWeight: 425.54048

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(OC1(CCCCC(=O)N)C2=CC=CC=C2)O)SCCC3=CC=CC=C3

Isomeric SMILES

C1C(=O)C(=C(OC1(CCCCC(=O)N)C2=CC=CC=C2)O)SCCC3=CC=CC=C3

InChI

InChI=1S/C24H27NO4S/c25-21(27)13-7-8-15-24(19-11-5-2-6-12-19)17-20(26)22(23(28)29-24)30-16-14-18-9-3-1-4-10-18/h1-6,9-12,28H,7-8,13-17H2,(H2,25,27)