N-(4,6-dimethylpyrimidin-2-yl)-4-[(3-methyl-5-oxidanylidene-1-pyridin-4-ylcarbonyl-4H-pyrazol-4-yl)diazenyl]benzenesulfonamide

Systemtic Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[(3-methyl-5-oxidanylidene-1-pyridin-4-ylcarbonyl-4H-pyrazol-4-yl)diazenyl]benzenesulfonamide Openeye Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[[3-methyl-5-oxo-1-(pyridine-4-carbonyl)-4H-pyrazol-4-yl]azo]benzenesulfonamide CAS Name: N-(4,6-dimethyl-2-pyrimidinyl)-4-[[3-methyl-5-oxo-1-[oxo(pyridin-4-yl)methyl]-4H-pyrazol-4-yl]azo]benzenesulfonamide IUPAC Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[[3-methyl-5-oxo-1-(pyridine-4-carbonyl)-4H-pyrazol-4-yl]diazenyl]benzenesulfonamide Traditional Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[(1-isonicotinoyl-5-keto-3-methyl-2-pyrazolin-4-yl)azo]benzenesulfonamide Formula: C22H20N8O4S MolecularWeight: 492.5104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N=NC3C(=NN(C3=O)C(=O)C4=CC=NC=C4)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N=NC3C(=NN(C3=O)C(=O)C4=CC=NC=C4)C)C

InChI

InChI=1S/C22H20N8O4S/c1-13-12-14(2)25-22(24-13)29-35(33,34)18-6-4-17(5-7-18)26-27-19-15(3)28-30(21(19)32)20(31)16-8-10-23-11-9-16/h4-12,19H,1-3H3,(H,24,25,29)