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

Systemtic Name: N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxidanylidene-5-propyl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxo-5-propyl-1H-pyrazol-4-yl]-2-oxo-ethyl]-4-nitro-benzenesulfonamide CAS Name: N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxo-5-propyl-1H-pyrazol-4-yl]-2-oxoethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxo-5-propyl-1H-pyrazol-4-yl]-2-oxoethyl]-4-nitrobenzenesulfonamide Traditional Name: N-butyl-N-[2-[1-(2-ethylphenyl)-5-keto-3-propyl-3-pyrazolin-4-yl]-2-keto-ethyl]-4-nitro-benzenesulfonamide Formula: C26H32N4O6S MolecularWeight: 528.62048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)C1=C(NN(C1=O)C2=CC=CC=C2CC)CCC)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC(=O)C1=C(NN(C1=O)C2=CC=CC=C2CC)CCC)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H32N4O6S/c1-4-7-17-28(37(35,36)21-15-13-20(14-16-21)30(33)34)18-24(31)25-22(10-5-2)27-29(26(25)32)23-12-9-8-11-19(23)6-3/h8-9,11-16,27H,4-7,10,17-18H2,1-3H3