6-(4-methylphenyl)-2-(2-oxidanylidenecyclohexyl)sulfanyl-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-methylphenyl)-2-(2-oxidanylidenecyclohexyl)sulfanyl-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-(2-oxocyclohexyl)sulfanyl-4-phenyl-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 6-(4-methylphenyl)-2-[(2-oxocyclohexyl)thio]-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 6-(4-methylphenyl)-2-(2-oxocyclohexyl)sulfanyl-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[(2-ketocyclohexyl)thio]-4-phenyl-6-(p-tolyl)nicotinonitrile Formula: C25H22N2OS MolecularWeight: 398.51998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SC4CCCCC4=O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SC4CCCCC4=O

InChI

InChI=1S/C25H22N2OS/c1-17-11-13-19(14-12-17)22-15-20(18-7-3-2-4-8-18)21(16-26)25(27-22)29-24-10-6-5-9-23(24)28/h2-4,7-8,11-15,24H,5-6,9-10H2,1H3