6-[5-[3-ethynyl-4-(furan-2-yl)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide

Systemtic Name: 6-[5-[3-ethynyl-4-(furan-2-yl)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide Openeye Name: 6-[5-[3-ethynyl-4-(2-furyl)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide CAS Name: 6-[5-[3-ethynyl-4-(2-furanyl)phenyl]-3-(trifluoromethyl)-1-pyrazolyl]-3-pyridinesulfonamide IUPAC Name: 6-[5-[3-ethynyl-4-(furan-2-yl)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide Traditional Name: 6-[5-[3-ethynyl-4-(2-furyl)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonamide Formula: C21H13F3N4O3S MolecularWeight: 458.41313

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C(C=CC(=C1)C2=CC(=NN2C3=NC=C(C=C3)S(=O)(=O)N)C(F)(F)F)C4=CC=CO4

Isomeric SMILES

C#CC1=C(C=CC(=C1)C2=CC(=NN2C3=NC=C(C=C3)S(=O)(=O)N)C(F)(F)F)C4=CC=CO4

InChI

InChI=1S/C21H13F3N4O3S/c1-2-13-10-14(5-7-16(13)18-4-3-9-31-18)17-11-19(21(22,23)24)27-28(17)20-8-6-15(12-26-20)32(25,29)30/h1,3-12H,(H2,25,29,30)