4-bromanyl-N-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]benzenesulfonamide Openeye Name: 4-bromo-N-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]benzenesulfonamide CAS Name: 4-bromo-N-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]benzenesulfonamide Traditional Name: 4-bromo-N-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]benzenesulfonamide Formula: C16H18BrN5O3S MolecularWeight: 440.31482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CNS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CNS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H18BrN5O3S/c17-13-2-4-14(5-3-13)26(24,25)20-12-15(23)21-8-10-22(11-9-21)16-18-6-1-7-19-16/h1-7,20H,8-12H2