3-[cyclopentyl(cyclopropylmethylsulfanyl)methyl]-2-oxidanyl-6-[1-(phenylmethyl)cyclopropyl]pyran-4-one

Systemtic Name: 3-[cyclopentyl(cyclopropylmethylsulfanyl)methyl]-2-oxidanyl-6-[1-(phenylmethyl)cyclopropyl]pyran-4-one Openeye Name: 6-(1-benzylcyclopropyl)-3-[cyclopentyl(cyclopropylmethylsulfanyl)methyl]-2-hydroxy-pyran-4-one CAS Name: 3-[cyclopentyl-(cyclopropylmethylthio)methyl]-2-hydroxy-6-[1-(phenylmethyl)cyclopropyl]-4-pyranone IUPAC Name: 6-(1-benzylcyclopropyl)-3-[cyclopentyl(cyclopropylmethylsulfanyl)methyl]-2-hydroxypyran-4-one Traditional Name: 6-(1-benzylcyclopropyl)-3-[cyclopentyl-(cyclopropylmethylthio)methyl]-2-hydroxy-pyran-4-one Formula: C25H30O3S MolecularWeight: 410.5689

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=C(OC(=CC2=O)C3(CC3)CC4=CC=CC=C4)O)SCC5CC5

Isomeric SMILES

C1CCC(C1)C(C2=C(OC(=CC2=O)C3(CC3)CC4=CC=CC=C4)O)SCC5CC5

InChI

InChI=1S/C25H30O3S/c26-20-14-21(25(12-13-25)15-17-6-2-1-3-7-17)28-24(27)22(20)23(19-8-4-5-9-19)29-16-18-10-11-18/h1-3,6-7,14,18-19,23,27H,4-5,8-13,15-16H2