2-[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1-prop-2-enyl-pyrazol-3-yl]oxy-1-thiophen-2-yl-ethanone

Systemtic Name: 2-[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1-prop-2-enyl-pyrazol-3-yl]oxy-1-thiophen-2-yl-ethanone Openeye Name: 2-[1-allyl-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyrazol-3-yl]oxy-1-(2-thienyl)ethanone CAS Name: 2-[[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1-prop-2-enyl-3-pyrazolyl]oxy]-1-thiophen-2-ylethanone IUPAC Name: 2-[4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1-prop-2-enylpyrazol-3-yl]oxy-1-thiophen-2-ylethanone Traditional Name: 2-[1-allyl-4-(4-fluorophenyl)-5-(4-mesylphenyl)pyrazol-3-yl]oxy-1-(2-thienyl)ethanone Formula: C25H21FN2O4S2 MolecularWeight: 496.573643

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NN2CC=C)OCC(=O)C3=CC=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=NN2CC=C)OCC(=O)C3=CC=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H21FN2O4S2/c1-3-14-28-24(18-8-12-20(13-9-18)34(2,30)31)23(17-6-10-19(26)11-7-17)25(27-28)32-16-21(29)22-5-4-15-33-22/h3-13,15H,1,14,16H2,2H3