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

Systemtic Name: 4-[[3-(1H-pyrazol-4-yl)-2-sulfanylidene-quinoxalin-1-yl]diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[3-(1H-pyrazol-4-yl)-2-thioxo-quinoxalin-1-yl]azo-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[[3-(1H-pyrazol-4-yl)-2-sulfanylidene-1-quinoxalinyl]azo]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[[3-(1H-pyrazol-4-yl)-2-sulfanylidenequinoxalin-1-yl]diazenyl]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[3-(1H-pyrazol-4-yl)-2-thioxo-quinoxalin-1-yl]azo-N-(2-pyrimidyl)benzenesulfonamide Formula: C21H15N9O2S2 MolecularWeight: 489.5329

Click to see the large picture

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=CNN=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=CNN=C5

InChI

InChI=1S/C21H15N9O2S2/c31-34(32,28-21-22-10-3-11-23-21)16-8-6-15(7-9-16)27-29-30-18-5-2-1-4-17(18)26-19(20(30)33)14-12-24-25-13-14/h1-13H,(H,24,25)(H,22,23,28)