1-ethyl-5-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)-3-phenethyl-pyrazole

Systemtic Name: 1-ethyl-5-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)-3-phenethyl-pyrazole Openeye Name: 1-ethyl-5-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)-3-phenethyl-pyrazole CAS Name: 1-ethyl-5-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)-3-phenethylpyrazole IUPAC Name: 1-ethyl-5-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)-3-phenethylpyrazole Traditional Name: 1-ethyl-5-(4-fluorophenyl)-4-(4-mesylphenyl)-3-phenethyl-pyrazole Formula: C26H25FN2O2S MolecularWeight: 448.552303

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)CCC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=C(C=C4)F

Isomeric SMILES

CCN1C(=C(C(=N1)CCC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H25FN2O2S/c1-3-29-26(21-10-14-22(27)15-11-21)25(20-12-16-23(17-13-20)32(2,30)31)24(28-29)18-9-19-7-5-4-6-8-19/h4-8,10-17H,3,9,18H2,1-2H3