4-[[3-[(Z)-3-oxidanylidene-1-piperidin-1-yl-prop-1-en-2-yl]-2-sulfanylidene-quinoxalin-1-yl]diazenyl]-N-pyridin-2-yl-benzenesulfonamide

Systemtic Name: 4-[[3-[(Z)-3-oxidanylidene-1-piperidin-1-yl-prop-1-en-2-yl]-2-sulfanylidene-quinoxalin-1-yl]diazenyl]-N-pyridin-2-yl-benzenesulfonamide Openeye Name: 4-[3-[(Z)-1-formyl-2-(1-piperidyl)vinyl]-2-thioxo-quinoxalin-1-yl]azo-N-(2-pyridyl)benzenesulfonamide CAS Name: 4-[[3-[(Z)-3-oxo-1-(1-piperidinyl)prop-1-en-2-yl]-2-sulfanylidene-1-quinoxalinyl]azo]-N-(2-pyridinyl)benzenesulfonamide IUPAC Name: 4-[[3-[(Z)-3-oxo-1-piperidin-1-ylprop-1-en-2-yl]-2-sulfanylidenequinoxalin-1-yl]diazenyl]-N-pyridin-2-ylbenzenesulfonamide Traditional Name: 4-[3-[(Z)-1-formyl-2-piperidino-vinyl]-2-thioxo-quinoxalin-1-yl]azo-N-(2-pyridyl)benzenesulfonamide Formula: C27H25N7O3S2 MolecularWeight: 559.6625

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C=C(C=O)C2=NC3=CC=CC=C3N(C2=S)N=NC4=CC=C(C=C4)S(=O)(=O)NC5=CC=CC=N5

Isomeric SMILES

C1CCN(CC1)/C=C(\C=O)/C2=NC3=CC=CC=C3N(C2=S)N=NC4=CC=C(C=C4)S(=O)(=O)NC5=CC=CC=N5

InChI

InChI=1S/C27H25N7O3S2/c35-19-20(18-33-16-6-1-7-17-33)26-27(38)34(24-9-3-2-8-23(24)29-26)32-30-21-11-13-22(14-12-21)39(36,37)31-25-10-4-5-15-28-25/h2-5,8-15,18-19H,1,6-7,16-17H2,(H,28,31)/b20-18+,32-30?