4-[5-(3-ethynyl-4-methoxy-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-fluoranyl-benzenesulfonamide

Systemtic Name: 4-[5-(3-ethynyl-4-methoxy-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-fluoranyl-benzenesulfonamide Openeye Name: 4-[5-(3-ethynyl-4-methoxy-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-fluoro-benzenesulfonamide CAS Name: 4-[5-(3-ethynyl-4-methoxyphenyl)-3-(trifluoromethyl)-1-pyrazolyl]-2-fluorobenzenesulfonamide IUPAC Name: 4-[5-(3-ethynyl-4-methoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-fluorobenzenesulfonamide Traditional Name: 4-[5-(3-ethynyl-4-methoxy-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-fluoro-benzenesulfonamide Formula: C19H13F4N3O3S MolecularWeight: 439.383433

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NN2C3=CC(=C(C=C3)S(=O)(=O)N)F)C(F)(F)F)C#C

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NN2C3=CC(=C(C=C3)S(=O)(=O)N)F)C(F)(F)F)C#C

InChI

InChI=1S/C19H13F4N3O3S/c1-3-11-8-12(4-6-16(11)29-2)15-10-18(19(21,22)23)25-26(15)13-5-7-17(14(20)9-13)30(24,27)28/h1,4-10H,2H3,(H2,24,27,28)