4-[[3-(1,2-oxazol-4-yl)-2-sulfanylidene-quinoxalin-1-yl]diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[[3-(1,2-oxazol-4-yl)-2-sulfanylidene-quinoxalin-1-yl]diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-(3-isoxazol-4-yl-2-thioxo-quinoxalin-1-yl)azo-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[[3-(4-isoxazolyl)-2-sulfanylidene-1-quinoxalinyl]azo]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[[3-(1,2-oxazol-4-yl)-2-sulfanylidenequinoxalin-1-yl]diazenyl]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-(3-isoxazol-4-yl-2-thioxo-quinoxalin-1-yl)azo-N-(2-pyrimidyl)benzenesulfonamide Formula: C21H14N8O3S2 MolecularWeight: 490.51766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=S)N2N=NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)C5=CON=C5

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=S)N2N=NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)C5=CON=C5

InChI

InChI=1S/C21H14N8O3S2/c30-34(31,27-21-22-10-3-11-23-21)16-8-6-15(7-9-16)26-28-29-18-5-2-1-4-17(18)25-19(20(29)33)14-12-24-32-13-14/h1-13H,(H,22,23,27)