[(E)-6-phenylhex-3-en-1,5-diyn-3-yl]sulfanylbenzene

Systemtic Name: [(E)-6-phenylhex-3-en-1,5-diyn-3-yl]sulfanylbenzene Openeye Name: [(E)-1-ethynyl-4-phenyl-but-1-en-3-ynyl]sulfanylbenzene CAS Name: [[(E)-6-phenylhex-3-en-1,5-diyn-3-yl]thio]benzene IUPAC Name: [(E)-6-phenylhex-3-en-1,5-diyn-3-yl]sulfanylbenzene Traditional Name: [[(E)-1-ethynyl-4-phenyl-but-1-en-3-ynyl]thio]benzene Formula: C18H12S MolecularWeight: 260.35288

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(=CC#CC1=CC=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

C#C/C(=C\C#CC1=CC=CC=C1)/SC2=CC=CC=C2

InChI

InChI=1S/C18H12S/c1-2-17(19-18-13-7-4-8-14-18)15-9-12-16-10-5-3-6-11-16/h1,3-8,10-11,13-15H/b17-15+