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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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