5-ethyl-2-[[1-(oxan-4-ylmethyl)cyclopropyl]methyl]-6-oxidanyl-3-(1-thiophen-2-ylethyl)pyran-4-one

Systemtic Name: 5-ethyl-2-[[1-(oxan-4-ylmethyl)cyclopropyl]methyl]-6-oxidanyl-3-(1-thiophen-2-ylethyl)pyran-4-one Openeye Name: 3-ethyl-2-hydroxy-6-[[1-(tetrahydropyran-4-ylmethyl)cyclopropyl]methyl]-5-[1-(2-thienyl)ethyl]pyran-4-one CAS Name: 3-ethyl-2-hydroxy-6-[[1-(4-oxanylmethyl)cyclopropyl]methyl]-5-(1-thiophen-2-ylethyl)-4-pyranone IUPAC Name: 3-ethyl-2-hydroxy-6-[[1-(oxan-4-ylmethyl)cyclopropyl]methyl]-5-(1-thiophen-2-ylethyl)pyran-4-one Traditional Name: 3-ethyl-2-hydroxy-6-[[1-(tetrahydropyran-4-ylmethyl)cyclopropyl]methyl]-5-[1-(2-thienyl)ethyl]pyran-4-one Formula: C23H30O4S MolecularWeight: 402.5469

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(OC(=C(C1=O)C(C)C2=CC=CS2)CC3(CC3)CC4CCOCC4)O

Isomeric SMILES

CCC1=C(OC(=C(C1=O)C(C)C2=CC=CS2)CC3(CC3)CC4CCOCC4)O

InChI

InChI=1S/C23H30O4S/c1-3-17-21(24)20(15(2)19-5-4-12-28-19)18(27-22(17)25)14-23(8-9-23)13-16-6-10-26-11-7-16/h4-5,12,15-16,25H,3,6-11,13-14H2,1-2H3