6-(4-methoxyphenyl)-2-[(1-oxidanylcyclohexyl)methylsulfanyl]-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-2-[(1-oxidanylcyclohexyl)methylsulfanyl]-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[(1-hydroxycyclohexyl)methylsulfanyl]-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile CAS Name: 2-[(1-hydroxycyclohexyl)methylthio]-6-(4-methoxyphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[(1-hydroxycyclohexyl)methylsulfanyl]-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[(1-hydroxycyclohexyl)methylthio]-6-(4-methoxyphenyl)-4-phenyl-nicotinonitrile Formula: C26H26N2O2S MolecularWeight: 430.56184

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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)SCC4(CCCCC4)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4(CCCCC4)O

InChI

InChI=1S/C26H26N2O2S/c1-30-21-12-10-20(11-13-21)24-16-22(19-8-4-2-5-9-19)23(17-27)25(28-24)31-18-26(29)14-6-3-7-15-26/h2,4-5,8-13,16,29H,3,6-7,14-15,18H2,1H3