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

Systemtic Name: 2-(2-oxidanylcyclohexyl)sulfanyl-4-phenyl-6-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-(2-hydroxycyclohexyl)sulfanyl-4-phenyl-6-(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[(2-hydroxycyclohexyl)thio]-4-phenyl-6-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-(2-hydroxycyclohexyl)sulfanyl-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[(2-hydroxycyclohexyl)thio]-4-phenyl-6-(2-thienyl)nicotinonitrile Formula: C22H20N2OS2 MolecularWeight: 392.537

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)O)SC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CCC(C(C1)O)SC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C22H20N2OS2/c23-14-17-16(15-7-2-1-3-8-15)13-18(20-11-6-12-26-20)24-22(17)27-21-10-5-4-9-19(21)25/h1-3,6-8,11-13,19,21,25H,4-5,9-10H2