4-(2,5-dimethylphenyl)sulfanylquinoline-3-carbonitrile

Systemtic Name: 4-(2,5-dimethylphenyl)sulfanylquinoline-3-carbonitrile Openeye Name: 4-(2,5-dimethylphenyl)sulfanylquinoline-3-carbonitrile CAS Name: 4-[(2,5-dimethylphenyl)thio]-3-quinolinecarbonitrile IUPAC Name: 4-(2,5-dimethylphenyl)sulfanylquinoline-3-carbonitrile Traditional Name: 4-[(2,5-dimethylphenyl)thio]quinoline-3-carbonitrile Formula: C18H14N2S MolecularWeight: 290.38216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N2S/c1-12-7-8-13(2)17(9-12)21-18-14(10-19)11-20-16-6-4-3-5-15(16)18/h3-9,11H,1-2H3