2-[2-(1-benzofuran-2-yl)-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[2-(1-benzofuran-2-yl)-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[2-(benzofuran-2-yl)-2-oxo-ethyl]sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[[2-(2-benzofuranyl)-2-oxoethyl]thio]-6-phenyl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[2-(1-benzofuran-2-yl)-2-oxoethyl]sulfanyl-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[[2-(benzofuran-2-yl)-2-keto-ethyl]thio]-6-phenyl-4-(trifluoromethyl)nicotinonitrile Formula: C23H13F3N2O2S MolecularWeight: 438.42173

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C23H13F3N2O2S/c24-23(25,26)17-11-18(14-6-2-1-3-7-14)28-22(16(17)12-27)31-13-19(29)21-10-15-8-4-5-9-20(15)30-21/h1-11H,13H2