6-(4-tert-butylphenyl)-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-tert-butylphenyl)-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-pyridine-3-carbonitrile Openeye Name: 6-(4-tert-butylphenyl)-2-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-phenyl-pyridine-3-carbonitrile CAS Name: 6-(4-tert-butylphenyl)-2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 6-(4-tert-butylphenyl)-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-phenylpyridine-3-carbonitrile Traditional Name: 6-(4-tert-butylphenyl)-2-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-4-phenyl-nicotinonitrile Formula: C31H28N2O2S MolecularWeight: 492.63122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H28N2O2S/c1-31(2,3)24-14-10-22(11-15-24)28-18-26(21-8-6-5-7-9-21)27(19-32)30(33-28)36-20-29(34)23-12-16-25(35-4)17-13-23/h5-18H,20H2,1-4H3