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

Systemtic Name: 4-[(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)azo]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)azo]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl)azo]-N-(2-pyrimidyl)benzenesulfonamide Formula: C20H17N7O3S MolecularWeight: 435.45908

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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)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C20H17N7O3S/c1-14-18(19(28)27(25-14)16-6-3-2-4-7-16)24-23-15-8-10-17(11-9-15)31(29,30)26-20-21-12-5-13-22-20/h2-13,18H,1H3,(H,21,22,26)