2-hexylsulfanyl-6-(4-methylphenyl)-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-hexylsulfanyl-6-(4-methylphenyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-hexylsulfanyl-4-phenyl-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 2-(hexylthio)-6-(4-methylphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-hexylsulfanyl-6-(4-methylphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-(hexylthio)-4-phenyl-6-(p-tolyl)nicotinonitrile Formula: C25H26N2S MolecularWeight: 386.55234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=C(C(=CC(=N1)C2=CC=C(C=C2)C)C3=CC=CC=C3)C#N

Isomeric SMILES

CCCCCCSC1=C(C(=CC(=N1)C2=CC=C(C=C2)C)C3=CC=CC=C3)C#N

InChI

InChI=1S/C25H26N2S/c1-3-4-5-9-16-28-25-23(18-26)22(20-10-7-6-8-11-20)17-24(27-25)21-14-12-19(2)13-15-21/h6-8,10-15,17H,3-5,9,16H2,1-2H3