2-methyl-4-methylsulfanyl-1-methylsulfonyl-benzene

Systemtic Name: 2-methyl-4-methylsulfanyl-1-methylsulfonyl-benzene Openeye Name: 2-methyl-4-methylsulfanyl-1-methylsulfonyl-benzene CAS Name: 2-methyl-1-methylsulfonyl-4-(methylthio)benzene IUPAC Name: 2-methyl-4-methylsulfanyl-1-methylsulfonylbenzene Traditional Name: 1-mesyl-2-methyl-4-(methylthio)benzene Formula: C9H12O2S2 MolecularWeight: 216.32038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12O2S2/c1-7-6-8(12-2)4-5-9(7)13(3,10)11/h4-6H,1-3H3