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

Systemtic Name: 1-[(E)-3-bromanyl-1-methylsulfanyl-pent-1-enyl]sulfonyl-4-methyl-benzene Openeye Name: 1-[(E)-3-bromo-1-methylsulfanyl-pent-1-enyl]sulfonyl-4-methyl-benzene CAS Name: 1-[(E)-3-bromo-1-(methylthio)pent-1-enyl]sulfonyl-4-methylbenzene IUPAC Name: 1-[(E)-3-bromo-1-methylsulfanylpent-1-enyl]sulfonyl-4-methylbenzene Traditional Name: 1-[(E)-3-bromo-1-(methylthio)pent-1-enyl]sulfonyl-4-methyl-benzene Formula: C13H17BrO2S2 MolecularWeight: 349.30688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(/C=C(\SC)/S(=O)(=O)C1=CC=C(C=C1)C)Br

InChI

InChI=1S/C13H17BrO2S2/c1-4-11(14)9-13(17-3)18(15,16)12-7-5-10(2)6-8-12/h5-9,11H,4H2,1-3H3/b13-9+