4-[4-[(3-methoxy-4-phenethyloxy-phenyl)methylidene]-5-oxidanylidene-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[4-[(3-methoxy-4-phenethyloxy-phenyl)methylidene]-5-oxidanylidene-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[4-[(3-methoxy-4-phenethyloxy-phenyl)methylene]-5-oxo-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[4-[(3-methoxy-4-phenethyloxyphenyl)methylidene]-5-oxo-3-(trifluoromethyl)-1-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[4-[(3-methoxy-4-phenethyloxyphenyl)methylidene]-5-oxo-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[5-keto-4-(3-methoxy-4-phenethyloxy-benzylidene)-3-(trifluoromethyl)-2-pyrazolin-1-yl]benzenesulfonamide Formula: C26H22F3N3O5S MolecularWeight: 545.53019

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)OCCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)OCCC4=CC=CC=C4

InChI

InChI=1S/C26H22F3N3O5S/c1-36-23-16-18(7-12-22(23)37-14-13-17-5-3-2-4-6-17)15-21-24(26(27,28)29)31-32(25(21)33)19-8-10-20(11-9-19)38(30,34)35/h2-12,15-16H,13-14H2,1H3,(H2,30,34,35)