[(E)-5,5-dimethyl-1-(phenylsulfonyl)hex-1-en-3-ynyl]sulfanylbenzene

Systemtic Name: [(E)-5,5-dimethyl-1-(phenylsulfonyl)hex-1-en-3-ynyl]sulfanylbenzene Openeye Name: [(E)-1-(benzenesulfonyl)-5,5-dimethyl-hex-1-en-3-ynyl]sulfanylbenzene CAS Name: [[(E)-1-(benzenesulfonyl)-5,5-dimethylhex-1-en-3-ynyl]thio]benzene IUPAC Name: [(E)-1-(benzenesulfonyl)-5,5-dimethylhex-1-en-3-ynyl]sulfanylbenzene Traditional Name: [[(E)-1-besyl-5,5-dimethyl-hex-1-en-3-ynyl]thio]benzene Formula: C20H20O2S2 MolecularWeight: 356.5016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC=C(SC1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C#C/C=C(\SC1=CC=CC=C1)/S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H20O2S2/c1-20(2,3)16-10-15-19(23-17-11-6-4-7-12-17)24(21,22)18-13-8-5-9-14-18/h4-9,11-15H,1-3H3/b19-15+