4-[(3R)-5-(4-fluorophenyl)-3-(4-nitrophenyl)-3,4-dihydropyrazol-2-yl]benzenesulfonamide

Systemtic Name: 4-[(3R)-5-(4-fluorophenyl)-3-(4-nitrophenyl)-3,4-dihydropyrazol-2-yl]benzenesulfonamide Openeye Name: 4-[(3R)-5-(4-fluorophenyl)-3-(4-nitrophenyl)-3,4-dihydropyrazol-2-yl]benzenesulfonamide CAS Name: 4-[(3R)-5-(4-fluorophenyl)-3-(4-nitrophenyl)-3,4-dihydropyrazol-2-yl]benzenesulfonamide IUPAC Name: 4-[(3R)-5-(4-fluorophenyl)-3-(4-nitrophenyl)-3,4-dihydropyrazol-2-yl]benzenesulfonamide Traditional Name: 4-[(5R)-3-(4-fluorophenyl)-5-(4-nitrophenyl)-2-pyrazolin-1-yl]benzenesulfonamide Formula: C21H17FN4O4S MolecularWeight: 440.447483

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)N)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1[C@@H](N(N=C1C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)N)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17FN4O4S/c22-16-5-1-14(2-6-16)20-13-21(15-3-7-18(8-4-15)26(27)28)25(24-20)17-9-11-19(12-10-17)31(23,29)30/h1-12,21H,13H2,(H2,23,29,30)/t21-/m1/s1