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

Systemtic Name: 3-(1-cyclopentylsulfanyl-3-methyl-butyl)-2-oxidanyl-6-phenyl-pyran-4-one Openeye Name: 3-(1-cyclopentylsulfanyl-3-methyl-butyl)-2-hydroxy-6-phenyl-pyran-4-one CAS Name: 3-[1-(cyclopentylthio)-3-methylbutyl]-2-hydroxy-6-phenyl-4-pyranone IUPAC Name: 3-(1-cyclopentylsulfanyl-3-methylbutyl)-2-hydroxy-6-phenylpyran-4-one Traditional Name: 3-[1-(cyclopentylthio)-3-methyl-butyl]-2-hydroxy-6-phenyl-pyran-4-one Formula: C21H26O3S MolecularWeight: 358.49434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=C(OC(=CC1=O)C2=CC=CC=C2)O)SC3CCCC3

Isomeric SMILES

CC(C)CC(C1=C(OC(=CC1=O)C2=CC=CC=C2)O)SC3CCCC3

InChI

InChI=1S/C21H26O3S/c1-14(2)12-19(25-16-10-6-7-11-16)20-17(22)13-18(24-21(20)23)15-8-4-3-5-9-15/h3-5,8-9,13-14,16,19,23H,6-7,10-12H2,1-2H3