N-butyl-N-[2-[2-(2,3-dimethylphenyl)-5-ethyl-3-oxidanylidene-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-butyl-N-[2-[2-(2,3-dimethylphenyl)-5-ethyl-3-oxidanylidene-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-butyl-N-[2-[2-(2,3-dimethylphenyl)-5-ethyl-3-oxo-1H-pyrazol-4-yl]-2-oxo-ethyl]-4-nitro-benzenesulfonamide CAS Name: N-butyl-N-[2-[2-(2,3-dimethylphenyl)-5-ethyl-3-oxo-1H-pyrazol-4-yl]-2-oxoethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-butyl-N-[2-[2-(2,3-dimethylphenyl)-5-ethyl-3-oxo-1H-pyrazol-4-yl]-2-oxoethyl]-4-nitrobenzenesulfonamide Traditional Name: N-butyl-N-[2-[1-(2,3-dimethylphenyl)-3-ethyl-5-keto-3-pyrazolin-4-yl]-2-keto-ethyl]-4-nitro-benzenesulfonamide Formula: C25H30N4O6S MolecularWeight: 514.5939

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)C1=C(NN(C1=O)C2=CC=CC(=C2C)C)CC)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC(=O)C1=C(NN(C1=O)C2=CC=CC(=C2C)C)CC)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H30N4O6S/c1-5-7-15-27(36(34,35)20-13-11-19(12-14-20)29(32)33)16-23(30)24-21(6-2)26-28(25(24)31)22-10-8-9-17(3)18(22)4/h8-14,26H,5-7,15-16H2,1-4H3