5-ethyl-2-[1-(4-methylphenyl)butan-2-yl]-6-oxidanyl-3-(1-thiophen-2-ylethyl)pyran-4-one

Systemtic Name: 5-ethyl-2-[1-(4-methylphenyl)butan-2-yl]-6-oxidanyl-3-(1-thiophen-2-ylethyl)pyran-4-one Openeye Name: 3-ethyl-2-hydroxy-6-[1-(p-tolylmethyl)propyl]-5-[1-(2-thienyl)ethyl]pyran-4-one CAS Name: 3-ethyl-2-hydroxy-6-[1-(4-methylphenyl)butan-2-yl]-5-(1-thiophen-2-ylethyl)-4-pyranone IUPAC Name: 3-ethyl-2-hydroxy-6-[1-(4-methylphenyl)butan-2-yl]-5-(1-thiophen-2-ylethyl)pyran-4-one Traditional Name: 3-ethyl-2-hydroxy-6-[1-(4-methylbenzyl)propyl]-5-[1-(2-thienyl)ethyl]pyran-4-one Formula: C24H28O3S MolecularWeight: 396.54232

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(OC(=C(C1=O)C(C)C2=CC=CS2)C(CC)CC3=CC=C(C=C3)C)O

Isomeric SMILES

CCC1=C(OC(=C(C1=O)C(C)C2=CC=CS2)C(CC)CC3=CC=C(C=C3)C)O

InChI

InChI=1S/C24H28O3S/c1-5-18(14-17-11-9-15(3)10-12-17)23-21(16(4)20-8-7-13-28-20)22(25)19(6-2)24(26)27-23/h7-13,16,18,26H,5-6,14H2,1-4H3