3-(1-cyclohexylsulfanyl-3-methyl-butyl)-2-oxidanyl-6-phenyl-pyran-4-one

Systemtic Name: 3-(1-cyclohexylsulfanyl-3-methyl-butyl)-2-oxidanyl-6-phenyl-pyran-4-one Openeye Name: 3-(1-cyclohexylsulfanyl-3-methyl-butyl)-2-hydroxy-6-phenyl-pyran-4-one CAS Name: 3-[1-(cyclohexylthio)-3-methylbutyl]-2-hydroxy-6-phenyl-4-pyranone IUPAC Name: 3-(1-cyclohexylsulfanyl-3-methylbutyl)-2-hydroxy-6-phenylpyran-4-one Traditional Name: 3-[1-(cyclohexylthio)-3-methyl-butyl]-2-hydroxy-6-phenyl-pyran-4-one Formula: C22H28O3S MolecularWeight: 372.52092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=C(OC(=CC1=O)C2=CC=CC=C2)O)SC3CCCCC3

Isomeric SMILES

CC(C)CC(C1=C(OC(=CC1=O)C2=CC=CC=C2)O)SC3CCCCC3

InChI

InChI=1S/C22H28O3S/c1-15(2)13-20(26-17-11-7-4-8-12-17)21-18(23)14-19(25-22(21)24)16-9-5-3-6-10-16/h3,5-6,9-10,14-15,17,20,24H,4,7-8,11-13H2,1-2H3