1-methyl-4-[2-(2-phenylsulfanylphenyl)ethynyl]benzene

Systemtic Name: 1-methyl-4-[2-(2-phenylsulfanylphenyl)ethynyl]benzene Openeye Name: 1-methyl-4-[2-(2-phenylsulfanylphenyl)ethynyl]benzene CAS Name: 1-methyl-4-[2-[2-(phenylthio)phenyl]ethynyl]benzene IUPAC Name: 1-methyl-4-[2-(2-phenylsulfanylphenyl)ethynyl]benzene Traditional Name: 1-methyl-4-[2-[2-(phenylthio)phenyl]ethynyl]benzene Formula: C21H16S MolecularWeight: 300.41674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC2=CC=CC=C2SC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C#CC2=CC=CC=C2SC3=CC=CC=C3

InChI

InChI=1S/C21H16S/c1-17-11-13-18(14-12-17)15-16-19-7-5-6-10-21(19)22-20-8-3-2-4-9-20/h2-14H,1H3