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

Systemtic Name: 4-(4-chlorophenyl)-2-(cyclohexylmethylsulfanyl)-6-(4-methoxyphenyl)pyridine-3-carbonitrile Openeye Name: 4-(4-chlorophenyl)-2-(cyclohexylmethylsulfanyl)-6-(4-methoxyphenyl)pyridine-3-carbonitrile CAS Name: 4-(4-chlorophenyl)-2-(cyclohexylmethylthio)-6-(4-methoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 4-(4-chlorophenyl)-2-(cyclohexylmethylsulfanyl)-6-(4-methoxyphenyl)pyridine-3-carbonitrile Traditional Name: 4-(4-chlorophenyl)-2-(cyclohexylmethylthio)-6-(4-methoxyphenyl)nicotinonitrile Formula: C26H25ClN2OS MolecularWeight: 449.0075

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H25ClN2OS/c1-30-22-13-9-20(10-14-22)25-15-23(19-7-11-21(27)12-8-19)24(16-28)26(29-25)31-17-18-5-3-2-4-6-18/h7-15,18H,2-6,17H2,1H3