1-methyl-4-(3-methyl-1-methylsulfanyl-butyl)sulfonyl-benzene

Systemtic Name: 1-methyl-4-(3-methyl-1-methylsulfanyl-butyl)sulfonyl-benzene Openeye Name: 1-methyl-4-(3-methyl-1-methylsulfanyl-butyl)sulfonyl-benzene CAS Name: 1-methyl-4-[3-methyl-1-(methylthio)butyl]sulfonylbenzene IUPAC Name: 1-methyl-4-(3-methyl-1-methylsulfanylbutyl)sulfonylbenzene Traditional Name: 1-methyl-4-[3-methyl-1-(methylthio)butyl]sulfonyl-benzene Formula: C13H20O2S2 MolecularWeight: 272.4267

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CC(C)C)SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CC(C)C)SC

InChI

InChI=1S/C13H20O2S2/c1-10(2)9-13(16-4)17(14,15)12-7-5-11(3)6-8-12/h5-8,10,13H,9H2,1-4H3