4-[4-([1]benzofuro[3,2-d]pyrimidin-4-yl)piperazin-1-yl]sulfonylbenzenesulfonamide

Systemtic Name: 4-[4-([1]benzofuro[3,2-d]pyrimidin-4-yl)piperazin-1-yl]sulfonylbenzenesulfonamide Openeye Name: 4-[4-(benzofuro[3,2-d]pyrimidin-4-yl)piperazin-1-yl]sulfonylbenzenesulfonamide CAS Name: 4-[[4-(4-benzofuro[3,2-d]pyrimidinyl)-1-piperazinyl]sulfonyl]benzenesulfonamide IUPAC Name: 4-[4-([1]benzofuro[3,2-d]pyrimidin-4-yl)piperazin-1-yl]sulfonylbenzenesulfonamide Traditional Name: 4-[4-(benzofuro[3,2-d]pyrimidin-4-yl)piperazino]sulfonylbenzenesulfonamide Formula: C20H19N5O5S2 MolecularWeight: 473.52536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2OC4=CC=CC=C43)S(=O)(=O)C5=CC=C(C=C5)S(=O)(=O)N

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2OC4=CC=CC=C43)S(=O)(=O)C5=CC=C(C=C5)S(=O)(=O)N

InChI

InChI=1S/C20H19N5O5S2/c21-31(26,27)14-5-7-15(8-6-14)32(28,29)25-11-9-24(10-12-25)20-19-18(22-13-23-20)16-3-1-2-4-17(16)30-19/h1-8,13H,9-12H2,(H2,21,26,27)