4-(4-methylphenyl)sulfanylquinoline-3-carbonitrile

Systemtic Name: 4-(4-methylphenyl)sulfanylquinoline-3-carbonitrile Openeye Name: 4-(p-tolylsulfanyl)quinoline-3-carbonitrile CAS Name: 4-[(4-methylphenyl)thio]-3-quinolinecarbonitrile IUPAC Name: 4-(4-methylphenyl)sulfanylquinoline-3-carbonitrile Traditional Name: 4-(p-tolylthio)quinoline-3-carbonitrile Formula: C17H12N2S MolecularWeight: 276.35558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=NC3=CC=CC=C32)C#N

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=NC3=CC=CC=C32)C#N

InChI

InChI=1S/C17H12N2S/c1-12-6-8-14(9-7-12)20-17-13(10-18)11-19-16-5-3-2-4-15(16)17/h2-9,11H,1H3