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

Systemtic Name: 4-[[3-(1-cyano-2-oxidanylidene-ethyl)-2-sulfanylidene-quinoxalin-1-yl]diazenyl]-N-(1,3-thiazol-2-yl)benzenesulfonamide Openeye Name: 4-[3-(1-cyano-2-oxo-ethyl)-2-thioxo-quinoxalin-1-yl]azo-N-thiazol-2-yl-benzenesulfonamide CAS Name: 4-[[3-(1-cyano-2-oxoethyl)-2-sulfanylidene-1-quinoxalinyl]azo]-N-(2-thiazolyl)benzenesulfonamide IUPAC Name: 4-[[3-(1-cyano-2-oxoethyl)-2-sulfanylidenequinoxalin-1-yl]diazenyl]-N-(1,3-thiazol-2-yl)benzenesulfonamide Traditional Name: 4-[3-(1-cyano-2-keto-ethyl)-2-thioxo-quinoxalin-1-yl]azo-N-thiazol-2-yl-benzenesulfonamide Formula: C20H13N7O3S3 MolecularWeight: 495.55732

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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=CS4)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=CS4)C(C=O)C#N

InChI

InChI=1S/C20H13N7O3S3/c21-11-13(12-28)18-19(31)27(17-4-2-1-3-16(17)23-18)26-24-14-5-7-15(8-6-14)33(29,30)25-20-22-9-10-32-20/h1-10,12-13H,(H,22,25)