6-(4-methoxyphenyl)-2-(3-methylbutylsulfanyl)-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-2-(3-methylbutylsulfanyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-isopentylsulfanyl-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile CAS Name: 6-(4-methoxyphenyl)-2-(3-methylbutylthio)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 6-(4-methoxyphenyl)-2-(3-methylbutylsulfanyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-(isoamylthio)-6-(4-methoxyphenyl)-4-phenyl-nicotinonitrile Formula: C24H24N2OS MolecularWeight: 388.52516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=C(C(=CC(=N1)C2=CC=C(C=C2)OC)C3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)CCSC1=C(C(=CC(=N1)C2=CC=C(C=C2)OC)C3=CC=CC=C3)C#N

InChI

InChI=1S/C24H24N2OS/c1-17(2)13-14-28-24-22(16-25)21(18-7-5-4-6-8-18)15-23(26-24)19-9-11-20(27-3)12-10-19/h4-12,15,17H,13-14H2,1-3H3