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

Systemtic Name: 2-(cyclohexylmethylsulfanyl)-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-(cyclohexylmethylsulfanyl)-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile CAS Name: 2-(cyclohexylmethylthio)-6-(4-methoxyphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-(cyclohexylmethylsulfanyl)-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-(cyclohexylmethylthio)-6-(4-methoxyphenyl)-4-phenyl-nicotinonitrile Formula: C26H26N2OS MolecularWeight: 414.56244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4CCCCC4

InChI

InChI=1S/C26H26N2OS/c1-29-22-14-12-21(13-15-22)25-16-23(20-10-6-3-7-11-20)24(17-27)26(28-25)30-18-19-8-4-2-5-9-19/h3,6-7,10-16,19H,2,4-5,8-9,18H2,1H3