4-[(4,8-dimethylquinolin-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[(4,8-dimethylquinolin-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[(4,8-dimethyl-2-quinolyl)sulfanylmethyl]benzonitrile CAS Name: 4-[[(4,8-dimethyl-2-quinolinyl)thio]methyl]benzonitrile IUPAC Name: 4-[(4,8-dimethylquinolin-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 4-[[(4,8-dimethyl-2-quinolyl)thio]methyl]benzonitrile Formula: C19H16N2S MolecularWeight: 304.40874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H16N2S/c1-13-4-3-5-17-14(2)10-18(21-19(13)17)22-12-16-8-6-15(11-20)7-9-16/h3-10H,12H2,1-2H3