2-[(1-oxidanylcyclohexyl)methylsulfanyl]-4,6-diphenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(1-oxidanylcyclohexyl)methylsulfanyl]-4,6-diphenyl-pyridine-3-carbonitrile Openeye Name: 2-[(1-hydroxycyclohexyl)methylsulfanyl]-4,6-diphenyl-pyridine-3-carbonitrile CAS Name: 2-[(1-hydroxycyclohexyl)methylthio]-4,6-diphenyl-3-pyridinecarbonitrile IUPAC Name: 2-[(1-hydroxycyclohexyl)methylsulfanyl]-4,6-diphenylpyridine-3-carbonitrile Traditional Name: 2-[(1-hydroxycyclohexyl)methylthio]-4,6-diphenyl-nicotinonitrile Formula: C25H24N2OS MolecularWeight: 400.53586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24N2OS/c26-17-22-21(19-10-4-1-5-11-19)16-23(20-12-6-2-7-13-20)27-24(22)29-18-25(28)14-8-3-9-15-25/h1-2,4-7,10-13,16,28H,3,8-9,14-15,18H2