1-butyl-4-(2-phenylsulfanylethynyl)benzene

Systemtic Name: 1-butyl-4-(2-phenylsulfanylethynyl)benzene Openeye Name: 1-butyl-4-(2-phenylsulfanylethynyl)benzene CAS Name: 1-butyl-4-[2-(phenylthio)ethynyl]benzene IUPAC Name: 1-butyl-4-(2-phenylsulfanylethynyl)benzene Traditional Name: 1-butyl-4-[2-(phenylthio)ethynyl]benzene Formula: C18H18S MolecularWeight: 266.40052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C#CSC2=CC=CC=C2

Isomeric SMILES

CCCCC1=CC=C(C=C1)C#CSC2=CC=CC=C2

InChI

InChI=1S/C18H18S/c1-2-3-7-16-10-12-17(13-11-16)14-15-19-18-8-5-4-6-9-18/h4-6,8-13H,2-3,7H2,1H3