2-[3-(4-tert-butylphenoxy)-2-oxidanyl-propyl]sulfanyl-6-(4-methylphenyl)-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[3-(4-tert-butylphenoxy)-2-oxidanyl-propyl]sulfanyl-6-(4-methylphenyl)-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[3-(4-tert-butylphenoxy)-2-hydroxy-propyl]sulfanyl-4-phenyl-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 2-[[3-(4-tert-butylphenoxy)-2-hydroxypropyl]thio]-6-(4-methylphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[3-(4-tert-butylphenoxy)-2-hydroxypropyl]sulfanyl-6-(4-methylphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[[3-(4-tert-butylphenoxy)-2-hydroxy-propyl]thio]-4-phenyl-6-(p-tolyl)nicotinonitrile Formula: C32H32N2O2S MolecularWeight: 508.67368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC(COC4=CC=C(C=C4)C(C)(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC(COC4=CC=C(C=C4)C(C)(C)C)O

InChI

InChI=1S/C32H32N2O2S/c1-22-10-12-24(13-11-22)30-18-28(23-8-6-5-7-9-23)29(19-33)31(34-30)37-21-26(35)20-36-27-16-14-25(15-17-27)32(2,3)4/h5-18,26,35H,20-21H2,1-4H3