5-[3-ethynyl-4-(furan-2-yl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 5-[3-ethynyl-4-(furan-2-yl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 5-[3-ethynyl-4-(2-furyl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole CAS Name: 5-[3-ethynyl-4-(2-furanyl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 5-[3-ethynyl-4-(furan-2-yl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 5-[3-ethynyl-4-(2-furyl)phenyl]-1-(4-mesylphenyl)-3-(trifluoromethyl)pyrazole Formula: C23H15F3N2O3S MolecularWeight: 456.43701

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC(=C(C=C3)C4=CC=CO4)C#C

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC(=C(C=C3)C4=CC=CO4)C#C

InChI

InChI=1S/C23H15F3N2O3S/c1-3-15-13-16(6-11-19(15)21-5-4-12-31-21)20-14-22(23(24,25)26)27-28(20)17-7-9-18(10-8-17)32(2,29)30/h1,4-14H,2H3