3-(3-methylbutyl)-6-phenyl-4-(phenylmethylsulfanyl)pyran-2-one

Systemtic Name: 3-(3-methylbutyl)-6-phenyl-4-(phenylmethylsulfanyl)pyran-2-one Openeye Name: 4-benzylsulfanyl-3-isopentyl-6-phenyl-pyran-2-one CAS Name: 3-(3-methylbutyl)-6-phenyl-4-(phenylmethylthio)-2-pyranone IUPAC Name: 4-benzylsulfanyl-3-(3-methylbutyl)-6-phenylpyran-2-one Traditional Name: 4-(benzylthio)-3-isoamyl-6-phenyl-pyran-2-one Formula: C23H24O2S MolecularWeight: 364.50046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=C(C=C(OC1=O)C2=CC=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCC1=C(C=C(OC1=O)C2=CC=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C23H24O2S/c1-17(2)13-14-20-22(26-16-18-9-5-3-6-10-18)15-21(25-23(20)24)19-11-7-4-8-12-19/h3-12,15,17H,13-14,16H2,1-2H3