N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxidanylidene-5-propyl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-2,4,6-trimethyl-benzenesulfonamide

Systemtic Name: N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxidanylidene-5-propyl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxo-5-propyl-1H-pyrazol-4-yl]-2-oxo-ethyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxo-5-propyl-1H-pyrazol-4-yl]-2-oxoethyl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxo-5-propyl-1H-pyrazol-4-yl]-2-oxoethyl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-butyl-N-[2-[1-(2-ethylphenyl)-5-keto-3-propyl-3-pyrazolin-4-yl]-2-keto-ethyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C29H39N3O4S MolecularWeight: 525.70266

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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=C(C=C(C=C3C)C)C

Isomeric SMILES

CCCCN(CC(=O)C1=C(NN(C1=O)C2=CC=CC=C2CC)CCC)S(=O)(=O)C3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C29H39N3O4S/c1-7-10-16-31(37(35,36)28-21(5)17-20(4)18-22(28)6)19-26(33)27-24(13-8-2)30-32(29(27)34)25-15-12-11-14-23(25)9-3/h11-12,14-15,17-18,30H,7-10,13,16,19H2,1-6H3