3-[(3,4-dimethoxyphenoxy)methyl]-1-(4-methylsulfonylphenyl)-5-phenyl-pyrazole

Systemtic Name: 3-[(3,4-dimethoxyphenoxy)methyl]-1-(4-methylsulfonylphenyl)-5-phenyl-pyrazole Openeye Name: 3-[(3,4-dimethoxyphenoxy)methyl]-1-(4-methylsulfonylphenyl)-5-phenyl-pyrazole CAS Name: 3-[(3,4-dimethoxyphenoxy)methyl]-1-(4-methylsulfonylphenyl)-5-phenylpyrazole IUPAC Name: 3-[(3,4-dimethoxyphenoxy)methyl]-1-(4-methylsulfonylphenyl)-5-phenylpyrazole Traditional Name: 3-[(3,4-dimethoxyphenoxy)methyl]-1-(4-mesylphenyl)-5-phenyl-pyrazole Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)OCC2=NN(C(=C2)C3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)OCC2=NN(C(=C2)C3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)C)OC

InChI

InChI=1S/C25H24N2O5S/c1-30-24-14-11-21(16-25(24)31-2)32-17-19-15-23(18-7-5-4-6-8-18)27(26-19)20-9-12-22(13-10-20)33(3,28)29/h4-16H,17H2,1-3H3