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

Systemtic Name: 2-[(1-oxidanylcyclohexyl)methylsulfanyl]-4-phenyl-6-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[(1-hydroxycyclohexyl)methylsulfanyl]-4-phenyl-6-(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[(1-hydroxycyclohexyl)methylthio]-4-phenyl-6-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[(1-hydroxycyclohexyl)methylsulfanyl]-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[(1-hydroxycyclohexyl)methylthio]-4-phenyl-6-(2-thienyl)nicotinonitrile Formula: C23H22N2OS2 MolecularWeight: 406.56358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=CC=C4)C#N)O

Isomeric SMILES

C1CCC(CC1)(CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=CC=C4)C#N)O

InChI

InChI=1S/C23H22N2OS2/c24-15-19-18(17-8-3-1-4-9-17)14-20(21-10-7-13-27-21)25-22(19)28-16-23(26)11-5-2-6-12-23/h1,3-4,7-10,13-14,26H,2,5-6,11-12,16H2