2-but-3-ynoxy-5-(4-fluorophenyl)-3-[2-(trifluoromethyl)pyridin-4-yl]benzenesulfonamide

Systemtic Name: 2-but-3-ynoxy-5-(4-fluorophenyl)-3-[2-(trifluoromethyl)pyridin-4-yl]benzenesulfonamide Openeye Name: 2-but-3-ynoxy-5-(4-fluorophenyl)-3-[2-(trifluoromethyl)-4-pyridyl]benzenesulfonamide CAS Name: 2-but-3-ynoxy-5-(4-fluorophenyl)-3-[2-(trifluoromethyl)-4-pyridinyl]benzenesulfonamide IUPAC Name: 2-but-3-ynoxy-5-(4-fluorophenyl)-3-[2-(trifluoromethyl)pyridin-4-yl]benzenesulfonamide Traditional Name: 2-but-3-ynoxy-5-(4-fluorophenyl)-3-[2-(trifluoromethyl)-4-pyridyl]benzenesulfonamide Formula: C22H16F4N2O3S MolecularWeight: 464.432653

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCOC1=C(C=C(C=C1S(=O)(=O)N)C2=CC=C(C=C2)F)C3=CC(=NC=C3)C(F)(F)F

Isomeric SMILES

C#CCCOC1=C(C=C(C=C1S(=O)(=O)N)C2=CC=C(C=C2)F)C3=CC(=NC=C3)C(F)(F)F

InChI

InChI=1S/C22H16F4N2O3S/c1-2-3-10-31-21-18(15-8-9-28-20(13-15)22(24,25)26)11-16(12-19(21)32(27,29)30)14-4-6-17(23)7-5-14/h1,4-9,11-13H,3,10H2,(H2,27,29,30)