1,2,3-trimethoxy-5-[2-(4-methylsulfanylphenyl)ethynyl]benzene

Systemtic Name: 1,2,3-trimethoxy-5-[2-(4-methylsulfanylphenyl)ethynyl]benzene Openeye Name: 1,2,3-trimethoxy-5-[2-(4-methylsulfanylphenyl)ethynyl]benzene CAS Name: 1,2,3-trimethoxy-5-[2-[4-(methylthio)phenyl]ethynyl]benzene IUPAC Name: 1,2,3-trimethoxy-5-[2-(4-methylsulfanylphenyl)ethynyl]benzene Traditional Name: 1,2,3-trimethoxy-5-[2-[4-(methylthio)phenyl]ethynyl]benzene Formula: C18H18O3S MolecularWeight: 314.39872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C#CC2=CC=C(C=C2)SC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C#CC2=CC=C(C=C2)SC

InChI

InChI=1S/C18H18O3S/c1-19-16-11-14(12-17(20-2)18(16)21-3)6-5-13-7-9-15(22-4)10-8-13/h7-12H,1-4H3