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

Systemtic Name: 3-[cyclopropyl(phenyl)methyl]-2-oxidanyl-6-(1-thiophen-3-ylpentan-3-yl)pyran-4-one Openeye Name: 3-[cyclopropyl(phenyl)methyl]-6-[1-ethyl-3-(3-thienyl)propyl]-2-hydroxy-pyran-4-one CAS Name: 3-[cyclopropyl(phenyl)methyl]-2-hydroxy-6-[1-(3-thiophenyl)pentan-3-yl]-4-pyranone IUPAC Name: 3-[cyclopropyl(phenyl)methyl]-2-hydroxy-6-(1-thiophen-3-ylpentan-3-yl)pyran-4-one Traditional Name: 3-[cyclopropyl(phenyl)methyl]-6-[1-ethyl-3-(3-thienyl)propyl]-2-hydroxy-pyran-4-one Formula: C24H26O3S MolecularWeight: 394.52644

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CSC=C1)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC=CC=C4

Isomeric SMILES

CCC(CCC1=CSC=C1)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H26O3S/c1-2-17(9-8-16-12-13-28-15-16)21-14-20(25)23(24(26)27-21)22(19-10-11-19)18-6-4-3-5-7-18/h3-7,12-15,17,19,22,26H,2,8-11H2,1H3