1-methylsulfanyl-3-(methylsulfonylmethyl)benzene

Systemtic Name: 1-methylsulfanyl-3-(methylsulfonylmethyl)benzene Openeye Name: 1-methylsulfanyl-3-(methylsulfonylmethyl)benzene CAS Name: 1-(methylsulfonylmethyl)-3-(methylthio)benzene IUPAC Name: 1-methylsulfanyl-3-(methylsulfonylmethyl)benzene Traditional Name: 1-(mesylmethyl)-3-(methylthio)benzene Formula: C9H12O2S2 MolecularWeight: 216.32038

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)CS(=O)(=O)C

Isomeric SMILES

CSC1=CC=CC(=C1)CS(=O)(=O)C

InChI

InChI=1S/C9H12O2S2/c1-12-9-5-3-4-8(6-9)7-13(2,10)11/h3-6H,7H2,1-2H3