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

Systemtic Name: 4-[[3-methyl-5-oxidanylidene-1-(phenylcarbonyl)-4H-pyrazol-4-yl]diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[(1-benzoyl-3-methyl-5-oxo-4H-pyrazol-4-yl)azo]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[(1-benzoyl-3-methyl-5-oxo-4H-pyrazol-4-yl)azo]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[(1-benzoyl-3-methyl-5-oxo-4H-pyrazol-4-yl)diazenyl]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[(1-benzoyl-5-keto-3-methyl-2-pyrazolin-4-yl)azo]-N-(2-pyrimidyl)benzenesulfonamide Formula: C21H17N7O4S MolecularWeight: 463.46918

Click to see the large picture

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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C21H17N7O4S/c1-14-18(20(30)28(26-14)19(29)15-6-3-2-4-7-15)25-24-16-8-10-17(11-9-16)33(31,32)27-21-22-12-5-13-23-21/h2-13,18H,1H3,(H,22,23,27)