4-[4-[(1,3-diphenylpyrazol-4-yl)methylidene]-5-oxidanylidene-1,3-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[4-[(1,3-diphenylpyrazol-4-yl)methylidene]-5-oxidanylidene-1,3-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[4-[(1,3-diphenylpyrazol-4-yl)methylene]-5-oxo-oxazol-2-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[4-[(1,3-diphenyl-4-pyrazolyl)methylidene]-5-oxo-2-oxazolyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[4-[(1,3-diphenylpyrazol-4-yl)methylidene]-5-oxo-1,3-oxazol-2-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[4-[(1,3-diphenylpyrazol-4-yl)methylene]-5-keto-2-oxazolin-2-yl]-N,N-diethyl-benzenesulfonamide Formula: C29H26N4O4S MolecularWeight: 526.60614

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=NC(=CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=NC(=CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O2

InChI

InChI=1S/C29H26N4O4S/c1-3-32(4-2)38(35,36)25-17-15-22(16-18-25)28-30-26(29(34)37-28)19-23-20-33(24-13-9-6-10-14-24)31-27(23)21-11-7-5-8-12-21/h5-20H,3-4H2,1-2H3