1-(2-fluorophenyl)-6-methyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: 1-(2-fluorophenyl)-6-methyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: 1-(2-fluorophenyl)-6-methyl-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]-4-oxo-pyridazine-3-carboxamide CAS Name: 1-(2-fluorophenyl)-6-methyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-4-oxo-3-pyridazinecarboxamide IUPAC Name: 1-(2-fluorophenyl)-6-methyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-4-oxopyridazine-3-carboxamide Traditional Name: 1-(2-fluorophenyl)-4-keto-N-[2-(4-mesyl-2-nitro-anilino)ethyl]-6-methyl-pyridazine-3-carboxamide Formula: C21H20FN5O6S MolecularWeight: 489.476803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C21H20FN5O6S/c1-13-11-19(28)20(25-26(13)17-6-4-3-5-15(17)22)21(29)24-10-9-23-16-8-7-14(34(2,32)33)12-18(16)27(30)31/h3-8,11-12,23H,9-10H2,1-2H3,(H,24,29)