4-[2-(5-butylsulfanylthiophen-2-yl)ethynyl]benzenecarbonitrile

Systemtic Name: 4-[2-(5-butylsulfanylthiophen-2-yl)ethynyl]benzenecarbonitrile Openeye Name: 4-[2-(5-butylsulfanyl-2-thienyl)ethynyl]benzonitrile CAS Name: 4-[2-[5-(butylthio)-2-thiophenyl]ethynyl]benzonitrile IUPAC Name: 4-[2-(5-butylsulfanylthiophen-2-yl)ethynyl]benzonitrile Traditional Name: 4-[2-[5-(butylthio)-2-thienyl]ethynyl]benzonitrile Formula: C17H15NS2 MolecularWeight: 297.4377

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(S1)C#CC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCSC1=CC=C(S1)C#CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H15NS2/c1-2-3-12-19-17-11-10-16(20-17)9-8-14-4-6-15(13-18)7-5-14/h4-7,10-11H,2-3,12H2,1H3