3-(phenylmethylsulfanyl)-6-propyl-pyran-2-one

Systemtic Name: 3-(phenylmethylsulfanyl)-6-propyl-pyran-2-one Openeye Name: 3-benzylsulfanyl-6-propyl-pyran-2-one CAS Name: 3-(phenylmethylthio)-6-propyl-2-pyranone IUPAC Name: 3-benzylsulfanyl-6-propylpyran-2-one Traditional Name: 3-(benzylthio)-6-propyl-pyran-2-one Formula: C15H16O2S MolecularWeight: 260.35134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C(=O)O1)SCC2=CC=CC=C2

Isomeric SMILES

CCCC1=CC=C(C(=O)O1)SCC2=CC=CC=C2

InChI

InChI=1S/C15H16O2S/c1-2-6-13-9-10-14(15(16)17-13)18-11-12-7-4-3-5-8-12/h3-5,7-10H,2,6,11H2,1H3