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

Systemtic Name: 4-[5-ethynyl-3-phenyl-4-(1,3-thiazol-4-yl)-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide Openeye Name: 4-[5-ethynyl-3-phenyl-4-thiazol-4-yl-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide CAS Name: 4-[5-ethynyl-3-phenyl-4-(4-thiazolyl)-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide IUPAC Name: 4-[5-ethynyl-3-phenyl-4-(1,3-thiazol-4-yl)-5-(trifluoromethyl)-1H-pyrazol-2-yl]benzenesulfonamide Traditional Name: 4-[3-ethynyl-5-phenyl-4-thiazol-4-yl-3-(trifluoromethyl)-3-pyrazolin-1-yl]benzenesulfonamide Formula: C21H15F3N4O2S2 MolecularWeight: 476.49461

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(C(=C(N(N1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3)C4=CSC=N4)C(F)(F)F

Isomeric SMILES

C#CC1(C(=C(N(N1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3)C4=CSC=N4)C(F)(F)F

InChI

InChI=1S/C21H15F3N4O2S2/c1-2-20(21(22,23)24)18(17-12-31-13-26-17)19(14-6-4-3-5-7-14)28(27-20)15-8-10-16(11-9-15)32(25,29)30/h1,3-13,27H,(H2,25,29,30)