4-[[3-(1-cyano-2-oxidanylidene-ethyl)-2-sulfanylidene-quinoxalin-1-yl]diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[[3-(1-cyano-2-oxidanylidene-ethyl)-2-sulfanylidene-quinoxalin-1-yl]diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[3-(1-cyano-2-oxo-ethyl)-2-thioxo-quinoxalin-1-yl]azo-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[[3-(1-cyano-2-oxoethyl)-2-sulfanylidene-1-quinoxalinyl]azo]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[[3-(1-cyano-2-oxoethyl)-2-sulfanylidenequinoxalin-1-yl]diazenyl]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[3-(1-cyano-2-keto-ethyl)-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)C(C=O)C#N

Isomeric SMILES

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

InChI

InChI=1S/C21H14N8O3S2/c22-12-14(13-30)19-20(33)29(18-5-2-1-4-17(18)25-19)28-26-15-6-8-16(9-7-15)34(31,32)27-21-23-10-3-11-24-21/h1-11,13-14H,(H,23,24,27)