1-[3-(3-pentanoylphenyl)sulfonylsulfanylphenyl]pentan-1-one

Systemtic Name: 1-[3-(3-pentanoylphenyl)sulfonylsulfanylphenyl]pentan-1-one Openeye Name: 1-[3-(3-pentanoylphenyl)sulfonylsulfanylphenyl]pentan-1-one CAS Name: 1-[3-[[3-(1-oxopentyl)phenyl]sulfonylthio]phenyl]-1-pentanone IUPAC Name: 1-[3-(3-pentanoylphenyl)sulfonylsulfanylphenyl]pentan-1-one Traditional Name: 1-[3-[(3-valerylphenyl)sulfonylthio]phenyl]pentan-1-one Formula: C22H26O4S2 MolecularWeight: 418.56944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=CC(=CC=C1)SS(=O)(=O)C2=CC=CC(=C2)C(=O)CCCC

Isomeric SMILES

CCCCC(=O)C1=CC(=CC=C1)SS(=O)(=O)C2=CC=CC(=C2)C(=O)CCCC

InChI

InChI=1S/C22H26O4S2/c1-3-5-13-21(23)17-9-7-11-19(15-17)27-28(25,26)20-12-8-10-18(16-20)22(24)14-6-4-2/h7-12,15-16H,3-6,13-14H2,1-2H3