1-methyl-4-(methylsulfonylmethylsulfanyl)benzene

Systemtic Name: 1-methyl-4-(methylsulfonylmethylsulfanyl)benzene Openeye Name: 1-methyl-4-(methylsulfonylmethylsulfanyl)benzene CAS Name: 1-methyl-4-(methylsulfonylmethylthio)benzene IUPAC Name: 1-methyl-4-(methylsulfonylmethylsulfanyl)benzene Traditional Name: 1-(mesylmethylthio)-4-methyl-benzene Formula: C9H12O2S2 MolecularWeight: 216.32038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SCS(=O)(=O)C

InChI

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