1-[(E)-3-bromanyl-1-methylsulfanyl-but-1-enyl]sulfonyl-4-methyl-benzene

Systemtic Name: 1-[(E)-3-bromanyl-1-methylsulfanyl-but-1-enyl]sulfonyl-4-methyl-benzene Openeye Name: 1-[(E)-3-bromo-1-methylsulfanyl-but-1-enyl]sulfonyl-4-methyl-benzene CAS Name: 1-[(E)-3-bromo-1-(methylthio)but-1-enyl]sulfonyl-4-methylbenzene IUPAC Name: 1-[(E)-3-bromo-1-methylsulfanylbut-1-enyl]sulfonyl-4-methylbenzene Traditional Name: 1-[(E)-3-bromo-1-(methylthio)but-1-enyl]sulfonyl-4-methyl-benzene Formula: C12H15BrO2S2 MolecularWeight: 335.2803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15BrO2S2/c1-9-4-6-11(7-5-9)17(14,15)12(16-3)8-10(2)13/h4-8,10H,1-3H3/b12-8+