5-[3-[(3-methylpyridin-2-yl)methoxy]-5-(4-methylsulfonylphenoxy)phenyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-[3-[(3-methylpyridin-2-yl)methoxy]-5-(4-methylsulfonylphenoxy)phenyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-[3-[(3-methyl-2-pyridyl)methoxy]-5-(4-methylsulfonylphenoxy)phenyl]-1,2-dihydropyrazol-3-one CAS Name: 5-[3-[(3-methyl-2-pyridinyl)methoxy]-5-(4-methylsulfonylphenoxy)phenyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-[3-[(3-methylpyridin-2-yl)methoxy]-5-(4-methylsulfonylphenoxy)phenyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-[3-(4-mesylphenoxy)-5-[(3-methyl-2-pyridyl)methoxy]phenyl]-3-pyrazolin-3-one Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)COC2=CC(=CC(=C2)OC3=CC=C(C=C3)S(=O)(=O)C)C4=CC(=O)NN4

Isomeric SMILES

CC1=C(N=CC=C1)COC2=CC(=CC(=C2)OC3=CC=C(C=C3)S(=O)(=O)C)C4=CC(=O)NN4

InChI

InChI=1S/C23H21N3O5S/c1-15-4-3-9-24-22(15)14-30-18-10-16(21-13-23(27)26-25-21)11-19(12-18)31-17-5-7-20(8-6-17)32(2,28)29/h3-13H,14H2,1-2H3,(H2,25,26,27)