6-[(4-methoxyphenyl)methyl]-2-oxidanyl-3-(1-phenylpentan-2-ylsulfanyl)pyran-4-one

Systemtic Name: 6-[(4-methoxyphenyl)methyl]-2-oxidanyl-3-(1-phenylpentan-2-ylsulfanyl)pyran-4-one Openeye Name: 3-(1-benzylbutylsulfanyl)-2-hydroxy-6-[(4-methoxyphenyl)methyl]pyran-4-one CAS Name: 2-hydroxy-6-[(4-methoxyphenyl)methyl]-3-(1-phenylpentan-2-ylthio)-4-pyranone IUPAC Name: 2-hydroxy-6-[(4-methoxyphenyl)methyl]-3-(1-phenylpentan-2-ylsulfanyl)pyran-4-one Traditional Name: 3-(1-benzylbutylthio)-2-hydroxy-6-p-anisyl-pyran-4-one Formula: C24H26O4S MolecularWeight: 410.52584

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC=CC=C1)SC2=C(OC(=CC2=O)CC3=CC=C(C=C3)OC)O

Isomeric SMILES

CCCC(CC1=CC=CC=C1)SC2=C(OC(=CC2=O)CC3=CC=C(C=C3)OC)O

InChI

InChI=1S/C24H26O4S/c1-3-7-21(15-17-8-5-4-6-9-17)29-23-22(25)16-20(28-24(23)26)14-18-10-12-19(27-2)13-11-18/h4-6,8-13,16,21,26H,3,7,14-15H2,1-2H3