1-[1-ethyl-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyrazol-3-yl]oxy-3,3-dimethyl-butan-2-one

Systemtic Name: 1-[1-ethyl-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyrazol-3-yl]oxy-3,3-dimethyl-butan-2-one Openeye Name: 1-[1-ethyl-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyrazol-3-yl]oxy-3,3-dimethyl-butan-2-one CAS Name: 1-[[1-ethyl-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-3-pyrazolyl]oxy]-3,3-dimethyl-2-butanone IUPAC Name: 1-[1-ethyl-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)pyrazol-3-yl]oxy-3,3-dimethylbutan-2-one Traditional Name: 1-[1-ethyl-4-(4-fluorophenyl)-5-(4-mesylphenyl)pyrazol-3-yl]oxy-3,3-dimethyl-butan-2-one Formula: C24H27FN2O4S MolecularWeight: 458.545583

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)OCC(=O)C(C)(C)C)C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCN1C(=C(C(=N1)OCC(=O)C(C)(C)C)C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C24H27FN2O4S/c1-6-27-22(17-9-13-19(14-10-17)32(5,29)30)21(16-7-11-18(25)12-8-16)23(26-27)31-15-20(28)24(2,3)4/h7-14H,6,15H2,1-5H3