1-methyl-4-(1-methylsulfanylpentylsulfonyl)benzene

Systemtic Name: 1-methyl-4-(1-methylsulfanylpentylsulfonyl)benzene Openeye Name: 1-methyl-4-(1-methylsulfanylpentylsulfonyl)benzene CAS Name: 1-methyl-4-[1-(methylthio)pentylsulfonyl]benzene IUPAC Name: 1-methyl-4-(1-methylsulfanylpentylsulfonyl)benzene Traditional Name: 1-methyl-4-[1-(methylthio)pentylsulfonyl]benzene Formula: C13H20O2S2 MolecularWeight: 272.4267

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(SC)S(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCC(SC)S(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C13H20O2S2/c1-4-5-6-13(16-3)17(14,15)12-9-7-11(2)8-10-12/h7-10,13H,4-6H2,1-3H3