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

Systemtic Name: 4-[[3-[(Z)-3-oxidanylidene-1-piperazin-1-yl-prop-1-en-2-yl]-2-sulfanylidene-quinoxalin-1-yl]diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[3-[(Z)-1-formyl-2-piperazin-1-yl-vinyl]-2-thioxo-quinoxalin-1-yl]azo-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[[3-[(Z)-3-oxo-1-(1-piperazinyl)prop-1-en-2-yl]-2-sulfanylidene-1-quinoxalinyl]azo]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[[3-[(Z)-3-oxo-1-piperazin-1-ylprop-1-en-2-yl]-2-sulfanylidenequinoxalin-1-yl]diazenyl]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[3-[(Z)-1-formyl-2-piperazino-vinyl]-2-thioxo-quinoxalin-1-yl]azo-N-(2-pyrimidyl)benzenesulfonamide Formula: C25H23N9O3S2 MolecularWeight: 561.63862

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C=C(C=O)C2=NC3=CC=CC=C3N(C2=S)N=NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5

Isomeric SMILES

C1CN(CCN1)/C=C(\C=O)/C2=NC3=CC=CC=C3N(C2=S)N=NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5

InChI

InChI=1S/C25H23N9O3S2/c35-17-18(16-33-14-12-26-13-15-33)23-24(38)34(22-5-2-1-4-21(22)29-23)32-30-19-6-8-20(9-7-19)39(36,37)31-25-27-10-3-11-28-25/h1-11,16-17,26H,12-15H2,(H,27,28,31)/b18-16+,32-30?