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

Systemtic Name: N-butyl-N-[2-[2-(3-chlorophenyl)-3-oxidanylidene-5-propyl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-butyl-N-[2-[2-(3-chlorophenyl)-3-oxo-5-propyl-1H-pyrazol-4-yl]-2-oxo-ethyl]-4-nitro-benzenesulfonamide CAS Name: N-butyl-N-[2-[2-(3-chlorophenyl)-3-oxo-5-propyl-1H-pyrazol-4-yl]-2-oxoethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-butyl-N-[2-[2-(3-chlorophenyl)-3-oxo-5-propyl-1H-pyrazol-4-yl]-2-oxoethyl]-4-nitrobenzenesulfonamide Traditional Name: N-butyl-N-[2-[1-(3-chlorophenyl)-5-keto-3-propyl-3-pyrazolin-4-yl]-2-keto-ethyl]-4-nitro-benzenesulfonamide Formula: C24H27ClN4O6S MolecularWeight: 535.01238

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C24H27ClN4O6S/c1-3-5-14-27(36(34,35)20-12-10-18(11-13-20)29(32)33)16-22(30)23-21(7-4-2)26-28(24(23)31)19-9-6-8-17(25)15-19/h6,8-13,15,26H,3-5,7,14,16H2,1-2H3