4-[[1-(4-tert-butylphenyl)carbonyl-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[[1-(4-tert-butylphenyl)carbonyl-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[[1-(4-tert-butylbenzoyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[[1-[(4-tert-butylphenyl)-oxomethyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[[1-(4-tert-butylbenzoyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[[1-(4-tert-butylbenzoyl)-5-keto-3-methyl-2-pyrazolin-4-yl]azo]-N-(2-pyrimidyl)benzenesulfonamide Formula: C25H25N7O4S MolecularWeight: 519.5755

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)C(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)C(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C25H25N7O4S/c1-16-21(23(34)32(30-16)22(33)17-6-8-18(9-7-17)25(2,3)4)29-28-19-10-12-20(13-11-19)37(35,36)31-24-26-14-5-15-27-24/h5-15,21H,1-4H3,(H,26,27,31)