N-(2-methoxydibenzofuran-3-yl)-2-[2,2,2-tris(fluoranyl)ethylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-(2-methoxydibenzofuran-3-yl)-2-[2,2,2-tris(fluoranyl)ethylsulfanyl]pyridine-3-carboxamide Openeye Name: N-(2-methoxydibenzofuran-3-yl)-2-(2,2,2-trifluoroethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(2-methoxy-3-dibenzofuranyl)-2-(2,2,2-trifluoroethylthio)-3-pyridinecarboxamide IUPAC Name: N-(2-methoxydibenzofuran-3-yl)-2-(2,2,2-trifluoroethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(2-methoxydibenzofuran-3-yl)-2-(2,2,2-trifluoroethylthio)nicotinamide Formula: C21H15F3N2O3S MolecularWeight: 432.41561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)C4=C(N=CC=C4)SCC(F)(F)F

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)C4=C(N=CC=C4)SCC(F)(F)F

InChI

InChI=1S/C21H15F3N2O3S/c1-28-18-9-14-12-5-2-3-7-16(12)29-17(14)10-15(18)26-19(27)13-6-4-8-25-20(13)30-11-21(22,23)24/h2-10H,11H2,1H3,(H,26,27)