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

Systemtic Name: 5-[3-ethynyl-4-(1,3-thiazol-4-yl)phenyl]-2-fluoranyl-4-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Openeye Name: 5-(3-ethynyl-4-thiazol-4-yl-phenyl)-2-fluoro-4-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide CAS Name: 5-[3-ethynyl-4-(4-thiazolyl)phenyl]-2-fluoro-4-(1-pyrazolyl)-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: 5-[3-ethynyl-4-(1,3-thiazol-4-yl)phenyl]-2-fluoro-4-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Traditional Name: 5-(3-ethynyl-4-thiazol-4-yl-phenyl)-2-fluoro-4-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Formula: C21H12F4N4O2S2 MolecularWeight: 492.469193

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C(C=CC(=C1)C2=CC(=C(C(=C2N3C=CC=N3)C(F)(F)F)F)S(=O)(=O)N)C4=CSC=N4

Isomeric SMILES

C#CC1=C(C=CC(=C1)C2=CC(=C(C(=C2N3C=CC=N3)C(F)(F)F)F)S(=O)(=O)N)C4=CSC=N4

InChI

InChI=1S/C21H12F4N4O2S2/c1-2-12-8-13(4-5-14(12)16-10-32-11-27-16)15-9-17(33(26,30)31)19(22)18(21(23,24)25)20(15)29-7-3-6-28-29/h1,3-11H,(H2,26,30,31)