3-[cyclopropyl(thiophen-2-yl)methyl]-6-[1-(oxan-3-yl)butan-2-yl]-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[cyclopropyl(thiophen-2-yl)methyl]-6-[1-(oxan-3-yl)butan-2-yl]-2-oxidanyl-pyran-4-one Openeye Name: 3-[cyclopropyl(2-thienyl)methyl]-2-hydroxy-6-[1-(tetrahydropyran-3-ylmethyl)propyl]pyran-4-one CAS Name: 3-[cyclopropyl(thiophen-2-yl)methyl]-2-hydroxy-6-[1-(3-oxanyl)butan-2-yl]-4-pyranone IUPAC Name: 3-[cyclopropyl(thiophen-2-yl)methyl]-2-hydroxy-6-[1-(oxan-3-yl)butan-2-yl]pyran-4-one Traditional Name: 3-[cyclopropyl(2-thienyl)methyl]-2-hydroxy-6-[1-(tetrahydropyran-3-ylmethyl)propyl]pyran-4-one Formula: C22H28O4S MolecularWeight: 388.52032

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1CCCOC1)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC=CS4

Isomeric SMILES

CCC(CC1CCCOC1)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC=CS4

InChI

InChI=1S/C22H28O4S/c1-2-15(11-14-5-3-9-25-13-14)18-12-17(23)21(22(24)26-18)20(16-7-8-16)19-6-4-10-27-19/h4,6,10,12,14-16,20,24H,2-3,5,7-9,11,13H2,1H3