6-(4-methoxyphenyl)-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-(4-methoxyphenyl)-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-(4-methoxyphenyl)-2-[[2-oxo-2-(4-phenylphenyl)ethyl]thio]-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-(4-methoxyphenyl)-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[[2-keto-2-(4-phenylphenyl)ethyl]thio]-6-(4-methoxyphenyl)-4-(trifluoromethyl)nicotinonitrile Formula: C28H19F3N2O2S MolecularWeight: 504.52287

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H19F3N2O2S/c1-35-22-13-11-20(12-14-22)25-15-24(28(29,30)31)23(16-32)27(33-25)36-17-26(34)21-9-7-19(8-10-21)18-5-3-2-4-6-18/h2-15H,17H2,1H3