N-[2-[3-(4-fluorophenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-[3-(4-fluorophenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-[3-(4-fluorophenyl)-6-oxo-pyridazin-1-yl]ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-[3-(4-fluorophenyl)-6-oxo-1-pyridazinyl]ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-[3-(4-fluorophenyl)-6-oxopyridazin-1-yl]ethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-[3-(4-fluorophenyl)-6-keto-pyridazin-1-yl]ethyl]-4-nitro-benzenesulfonamide Formula: C18H15FN4O5S MolecularWeight: 418.398903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C(=O)C=C2)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C(=O)C=C2)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C18H15FN4O5S/c19-14-3-1-13(2-4-14)17-9-10-18(24)22(21-17)12-11-20-29(27,28)16-7-5-15(6-8-16)23(25)26/h1-10,20H,11-12H2