6-(4-methoxyphenyl)-2-(2-oxidanylcyclohexyl)sulfanyl-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-2-(2-oxidanylcyclohexyl)sulfanyl-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-(2-hydroxycyclohexyl)sulfanyl-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile CAS Name: 2-[(2-hydroxycyclohexyl)thio]-6-(4-methoxyphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-(2-hydroxycyclohexyl)sulfanyl-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[(2-hydroxycyclohexyl)thio]-6-(4-methoxyphenyl)-4-phenyl-nicotinonitrile Formula: C25H24N2O2S MolecularWeight: 416.53526

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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)SC4CCCCC4O

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SC4CCCCC4O

InChI

InChI=1S/C25H24N2O2S/c1-29-19-13-11-18(12-14-19)22-15-20(17-7-3-2-4-8-17)21(16-26)25(27-22)30-24-10-6-5-9-23(24)28/h2-4,7-8,11-15,23-24,28H,5-6,9-10H2,1H3